CN104370902A - Apixaban novel crystal form and preparation method thereof - Google Patents

Apixaban novel crystal form and preparation method thereof Download PDF

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Publication number
CN104370902A
CN104370902A CN201310349409.XA CN201310349409A CN104370902A CN 104370902 A CN104370902 A CN 104370902A CN 201310349409 A CN201310349409 A CN 201310349409A CN 104370902 A CN104370902 A CN 104370902A
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eliquis
crystal form
preparation
crystal
solid
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王元
何训贵
张兴忠
丁旭锦
周岩锋
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2Y-CHEM LTD
2Y CHEM Ltd
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Priority to CN201310349409.XA priority Critical patent/CN104370902A/en
Priority to PCT/CN2014/084155 priority patent/WO2015021902A1/en
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    • CCHEMISTRY; METALLURGY
    • C07ORGANIC CHEMISTRY
    • C07DHETEROCYCLIC COMPOUNDS
    • C07D471/00Heterocyclic compounds containing nitrogen atoms as the only ring hetero atoms in the condensed system, at least one ring being a six-membered ring with one nitrogen atom, not provided for by groups C07D451/00 - C07D463/00
    • C07D471/02Heterocyclic compounds containing nitrogen atoms as the only ring hetero atoms in the condensed system, at least one ring being a six-membered ring with one nitrogen atom, not provided for by groups C07D451/00 - C07D463/00 in which the condensed system contains two hetero rings
    • C07D471/04Ortho-condensed systems

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  • Chemical & Material Sciences (AREA)
  • Organic Chemistry (AREA)
  • Pharmaceuticals Containing Other Organic And Inorganic Compounds (AREA)

Abstract

The invention relates to a novel apixaban crystal form named as A-type, and a preparation method thereof. The disclosed apixaban crystal form A has a characteristic absorption peak in an X-ray powder diffraction spectrum and a characteristic absorption peak in a differential scanning calorimeter (DSC) spectrum. The crystal form is stable and does not absorb water. The preparation method is simple and has a good repeatability.

Description

A kind of Novel apixaban crystal form and preparation method thereof
Technical field
The invention belongs to field of pharmaceutical chemistry technology.Be specifically related to be commonly called Eliquis (Apixaban), i.e. 1-(4-p-methoxy-phenyl)-7-oxo-6-[4-(2-oxo-piperidino) phenyl]-4,5,6, new crystal of 7-tetrahydrochysene-1H-pyrazolo [3,4-c] pyridine-3-carboxamide and preparation method thereof.
Background technology
The Chinese of Eliquis (Apixaban) is called: 1-(4-p-methoxy-phenyl)-7-oxo-6-[4-(2-oxo-piperidino) phenyl]-4,5,6,7-tetrahydrochysene-1H-pyrazolo [3,4-c] pyridine-3-carboxamide, English by name:
1-(4-methoxyphenyl)-7-oxo-6-(4-(2-oxopiperidin-1-yl)phenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxamide。Trade(brand)name: ELIQUIS.Structural formula is as follows:
Eliquis (Apixaban) is by Bristol-MyersSquibb(Bristol Myers Squibb) company's discovery, Hou You Pfizer (Pfizer) and Bristol-Myers Squibb Co.'s joint development.2011, European Union ratified it and uses in 27 member statess of European Union, occurs venous thromboembolism (VTE) event for preventing the adult patients accepting to select a time hip joint or knee replacements.FDA have approved this medicine and went on the market in the U.S. in December, 2012.
Eliquis (Apixaban) has multiple crystal formation, and WO03026652 first time discloses Eliquis and preparation method thereof.In US20060069258, first time openly reports polymorphic formH2-2(hydrate) and N-1(neat) two kinds of crystal formations.By react directly obtain for crystal formation H2-2, give also the method for transformation from crystal formation H2-2 to crystal formation N-1.At US20060069258(WO2007001385) report method polymorphic H2-2 being converted into N-1 crystal formation in patent families CN200580040778.4 embodiment 9, need first small quantities of H2-2 reaction solution to be put in transition tank shearing device to carry out shearing and stirring, H2-2 is changed into short grained N-1 stable crystal form, then large quantities of reaction solution is added shear-induced crystallization together.Therefore need special shearing device is installed.
US20070203178 patent protection crystal formation DMF-5 and FA-2, this two kinds of crystal formations can be used for preparing hydrate (H2-2) and N-1(neat) crystal formation.Crystal formation α is disclosed in WO2012168364.Crystal formation DMF-5, FA-2 and α can be converted into crystal formation N-1 under certain condition, but do not provide its method for transformation.
Now reporting in crystal formation, comparatively ambassador's used time need be converted into crystal formation N-1 to crystal formation H2-2 particle; Crystal formation DMF-5 and crystal formation FA-2 is respectively the crystal formation of DMF and FA solvation, and containing DMF and FA, high temperature is unstable; Crystal formation α is with electrostatic, and Yi Zhuanjing, is not suitable for preparation; Crystal formation N-1 stablizes, but its preparation technology needs special shearing device according to bibliographical information, just can obtain this crystal formation, and this shearing device does not also widely use at pharmacy field at present.
Wherein, the gimmick that crystallization art is conventional is induction crystallization.Induction crystallization generally needs crystal seed induction crystallization to refer to complete for a kind of solute clearly molten, obtains a whole clear soln.Then add required crystal seed in suitable temperature, slow cooling crystallization, obtain required crystal formation.Can therefore the preparation of crystal seed be most important, be the key that obtain the crystal formation wanted.Before the crystal seed not obtaining certain new crystal, certain solvent system often may separate out another crystal formation, and when add another crystal formation carry out inducing when, the crystal formation wanted can be changed into.
Summary of the invention
Technical problem to be solved by this invention is, by great many of experiments, work out a kind of stable novel Eliquis crystal formation, described crystal formation preparation method can supply industrialization.
The invention provides new crystal of a kind of Eliquis and preparation method thereof, this crystal formation called after A type.
Technical problem of the present invention is achieved by the following technical solution:
A kind of Eliquis crystal form A, its X-ray powder diffraction pattern is that 12.84 ± 0.2 °, 13.90 ± 0.2 °, 16.96 ± 0.2 °, 18.44 ± 0.2 °, 19.56 ± 0.2 ° and 32.74 ± 0.2 ° of places have characteristic peak at 2 θ.
Described Eliquis crystal form A has X-ray powder diffraction (XRPD) collection of illustrative plates as shown in Figure 1 substantially.
Described Eliquis crystal form A has substantially differential scanning calorimeter (DSC) collection of illustrative plates as shown in Figure 2.
DSC collection of illustrative plates shows: described Eliquis crystal form A has 235 ~ 242 DEG C of fusing endotherm(ic)peaks, and maximum heat absorption melt temperature is about 238 DEG C.
The test condition of DSC is: 30-300 DEG C, 10.0K/min, uncaps, nitrogen environment.
Described Eliquis crystal form A has substantially infrared (IR) collection of illustrative plates as shown in Figure 3.
Present invention also offers the preparation method of described Eliquis crystal form A, it comprises the steps:
(1) in room temperature under solvent boiling point temperature condition, dissolve in the organic solvent (namely 1g Eliquis is dissolved in 5 ~ 200mL organic solvent) Eliquis solid being joined 5 ~ 200 times of volume/weight ratio;
(2) at 0 ~ 150 DEG C, be preferably 40 ~ 150 DEG C, in step (1) gained solution, add the crystal seed of Eliquis crystal form A, be cooled to 0 ~ 30 DEG C, stir 0 ~ 48h, preferably 0.5 ~ 48h, obtain suspension liquid;
(3) solid is separated from suspension liquid;
(4) solid drying will be separated, obtains Eliquis crystal form A;
Wherein, the crystal seed of step (2) described Eliquis crystal form A is prepared by following method:
(2.1) in room temperature under solvent boiling point temperature condition, dissolve in the organic solvent (namely 1g Eliquis is dissolved in 5 ~ 400mL organic solvent) Eliquis solid being joined 5 ~ 400 times of volume/weight ratio;
(2.2) after solvent boiling point is incubated 0.5 hour ~ 10 hours, solution is slowly cooled to 0 ~ 30 DEG C, obtain a kind of suspension liquid;
(2.3) solid is separated from suspension liquid;
(2.4) by be separated solid 30 ~ 60 DEG C of dryings, obtain the crystal seed of Eliquis crystal form A.
Preferably,
Step (1) and step (2.1) described organic solvent independently be selected from ether, ester, ketone, alcoholic solvent or its combination; Ether solvent is wherein selected from methyl tertiary butyl ether (MTBE), ether, isopropyl ether or its combination; Esters solvent is selected from methyl-formiate, butyl formate, ethyl acetate, methyl acetate, butylacetate or its combination; Ketones solvent is selected from acetone, butanone or its combination; Alcoholic solvent is selected from methyl alcohol, ethanol, propyl alcohol, Virahol, butanols or its combination, and this alcohol also comprises moisture alcohol.
One or several the mixture of described organic solvent more preferably in methyl tertiary butyl ether, ether, acetone, ethyl acetate, methyl alcohol, ethanol, Virahol.
Organic solvent in step (1) and step (2.1) can disposablely add when being mixed solvent, adds another kind of organic solvent again after also first can adding a kind of organic solvent and Eliquis solids mixing.
Add the weight of the crystal seed of Eliquis crystal form A in step (2) for 1 ~ 50% of the Eliquis weight described in step (1), ensure that the crystal seed of Eliquis crystal form A is not completely dissolved.
Add the opportunity of the crystal seed of Eliquis crystal form A, need to add when basic saturation concentration, in order to avoid crystal seed dissolves, do not have inducing action.Substantially the saturated saturated solution referring to clarification, or have the undissolved Eliquis solid of a small amount of part.
The method be separated described in step (3) can comprise filtration, and washs with step (1) described organic solvent.
The method be separated described in step (2.3) can comprise filtration, and washs with step (2.1) described organic solvent.
Drying described in step (4), can use conventional drying, such as loft drier etc., temperature range is not limit, and is preferably 30-80 DEG C.
Room temperature of the present invention is about 25 DEG C.The boiling temperature that described solvent boiling point temperature is added organic solvent.
Of the present inventionly prepare that Eliquis polymorphic A is reproducible, easy and simple to handle, product utilization rate is high, purity is high, be applicable to suitability for industrialized production.
Eliquis crystal form A of the present invention is not containing crystal water and solvent, not static electrification, and have good stability, nonhygroscopic, its character is obviously better than the crystal formations such as crystal formation H2-2 of the prior art, crystal formation DMF-5, crystal formation FA-2, crystal formation α.According to existing bibliographical information, crystal formation DMF-5, crystal formation FA-2 can remain corresponding DMF(N, dinethylformamide) and methane amide; And crystal formation H2-2 is hydrate, grain size number is large, is not suitable for preparation; Crystal formation α static electrifications etc., are not suitable for preparation process requirement.
And the Eliquis crystal form A that the present invention relates to, its preparation method is simple, by crystallization and crystal seed induced crystallization, technique does not need specific installation.And in CN200580040778.4 embodiment 9, disclose the preparation method of Eliquis crystal formation N-1, it needs the slurry of Eliquis H2-2 to transfer in transition tank, change into short grained N-1 crystal after shearing after being heated to 55-60 DEG C, need through special shearing technique and and relevant device.Compared with crystal formation N-1, the preparation method of Eliquis crystal form A of the present invention is obviously simple, does not need specific installation, does not need, via other transformation of crystals, to reduce costs, workable.
Accompanying drawing explanation
The XRPD collection of illustrative plates of Fig. 1 embodiment 3 Eliquis A crystal formation;
The DSC collection of illustrative plates of Fig. 2 embodiment 3 Eliquis A crystal formation;
The IR collection of illustrative plates of Fig. 3 embodiment 3 Eliquis A crystal formation;
The DSC collection of illustrative plates of 6 days is placed in the illumination of Fig. 4 embodiment 3 Eliquis crystal form A;
Fig. 5 embodiment 3 Eliquis crystal form A high temperature places the DSC collection of illustrative plates of 6 days;
Fig. 6 embodiment 3 Eliquis crystal form A high humidity places the DSC collection of illustrative plates of 6 days;
The DSC collection of illustrative plates of Fig. 7 comparative example 4 Eliquis crystal formation α;
The DSC collection of illustrative plates of Fig. 8 comparative example 3 Eliquis crystal formation H2-2;
The DSC collection of illustrative plates of Fig. 9 comparative example 1 Eliquis crystal formation DMF-5;
The DSC collection of illustrative plates of Figure 10 comparative example 2 Eliquis crystal formation FA-2.
Embodiment
With specific embodiment, technical scheme of the present invention is described below, but protection scope of the present invention is not limited thereto.
Analyzing and testing condition of the present invention is as follows:
1, X-ray powder diffraction is recorded by RigakuD/max2550VB-pc diffractometer, adopts Cu/K-alphal (λ=1.540598 ) radiation, power: 40kV × 100mA gathers associated diffraction data in 2 θ 3 °-40 ° (or 2 °-40 °) scope, walks wide 0.02 °, sweep velocity 6 °/min.
2, DSC is detected by the resistance to DSC200F3 that speeds of Germany, and temperature range 30-300 DEG C, heat-up rate 10.0K/min, hole is pricked in sealing, nitrogen environment.
3, infrared spectra (IR) is detected by PEspectrumRXI, and temperature is 23 DEG C, and humidity is 54%.
In the Eliquis referenced patent CN1639147 used in the embodiment of the present invention prepared by embodiment 56.
The preparation of the crystal seed of embodiment 1 Eliquis crystal form A
0.5g Eliquis is joined in 150mL ethyl acetate, temperature is risen to 78 DEG C, be stirred to and obtain settled solution, insulated and stirred 1 hour, is cooled to 25 DEG C, stirs 48h, filter, with the washing of 1mL ethyl acetate, dry to obtain the crystal seed of Eliquis crystal form A 30 DEG C of air blast.
The preparation of the crystal seed of embodiment 2 Eliquis crystal form A
0.5g Eliquis is joined in the mixed solvent (volume ratio of ethanol and ethyl acetate is 4:1) of 13mL ethanol and ethyl acetate, temperature is risen to 78 DEG C, be stirred to and obtain settled solution, insulated and stirred 1 hour, be cooled to 25 DEG C, stir 3h, filter, wash with the mixed solvent (volume ratio of ethanol and ethyl acetate is 4:1) of 0.5mL ethanol and ethyl acetate, dry to obtain the crystal seed of Eliquis crystal form A 30 DEG C of air blast.
The preparation of the crystal seed of embodiment 3 Eliquis crystal form A
0.5g Eliquis is joined in the mixed solvent (volume ratio of methyl alcohol and MTBE is 1:2) of 22.5mL methyl alcohol and methyl tertiary butyl ether, temperature is risen to 60 DEG C, insulated and stirred 1 hour, be cooled to 25 DEG C, stir 3h, filter, wash with the mixed solvent (methyl alcohol and MTBE volume ratio are 1:2) of 1mL methyl alcohol and MTBE, dry to obtain the crystal seed of Eliquis crystal form A 30 DEG C of air blast.
The preparation of the crystal seed of embodiment 4 Eliquis crystal form A
0.5g Eliquis is joined in 7.5mL methyl alcohol, temperature is risen to 60 DEG C, insulated and stirred 1 hour, add 15mL methyl tertiary butyl ether, insulated and stirred 1.5 hours, is cooled to 25 DEG C, stir 3h, filter, wash with the mixed solvent (methyl alcohol and MTBE volume ratio are 1:2) of 1mL methyl alcohol and MTBE, dry to obtain the crystal seed of Eliquis crystal form A 30 DEG C of air blast.
The preparation of the crystal seed of embodiment 5 Eliquis crystal form A
0.5g Eliquis is joined in the mixed solvent (volume ratio of methyl alcohol and MTBE is 1:2) of 7.5mL methyl alcohol and methyl tertiary butyl ether, temperature is risen to 60 DEG C, insulated and stirred 1 hour, be cooled to 25 DEG C, stir 3h, filter, wash with the mixed solvent (methyl alcohol and MTBE volume ratio are 1:2) of 1mL methyl alcohol and MTBE, dry to obtain the crystal seed of Eliquis crystal form A 30 DEG C of air blast.
The preparation of embodiment 6 Eliquis crystal form A
0.2g Eliquis is joined in the mixed solvent (volume ratio of acetone and ethanol is 1:2) of 12mL acetone and ethanol, temperature is risen to 70 DEG C, stir, and add the crystal seed of the Eliquis crystal form A of embodiment 3 gained, naturally cooling, be cooled to 25 DEG C, stir 3h, filter, wash with the mixed solvent (volume ratio of acetone and ethanol is 1:2) of 1mL acetone and ethanol, dry to obtain Eliquis crystal form A 30 DEG C of air blast.
The preparation of embodiment 7 Eliquis crystal form A
0.2g Eliquis is joined in 20mL Virahol, temperature is risen to 82 DEG C, stir, and add the crystal seed of the Eliquis crystal form A of embodiment 3 gained, naturally cooling, is cooled to 25 DEG C, stirs 3h, filter, use 0.5mL washed with isopropyl alcohol, dry to obtain Eliquis crystal form A 30 DEG C of air blast.
The preparation of embodiment 8 Eliquis crystal form A
0.4g Eliquis is joined in the ethanol of 8mL95%, temperature is risen to 78 DEG C, stir, and add the crystal seed of the Eliquis crystal form A of embodiment 3 gained, naturally cooling, is cooled to 25 DEG C, stirs 16h, filter, by the washing with alcohol of 0.5mL95%, dry to obtain Eliquis crystal form A 30 DEG C of air blast.
The preparation of comparative example 1 crystal formation DMF-5
In the Eliquis crystal formation DMF-5 referenced patent US2007/0203178 used in the present invention prepared by embodiment 1.
The preparation of comparative example 2 crystal formation FA-2
In the Eliquis crystal formation FA-2 referenced patent US2007/0203178 used in the present invention prepared by embodiment 1.
The preparation of comparative example 3 crystal formation H2-2
In the Eliquis crystal formation H2-2 referenced patent CN200580040778.4 used in the present invention prepared by embodiment 9.
The preparation of comparative example 4 crystal formation α
In the Eliquis crystal formation α referenced patent WO2012168364 used in the present invention prepared by embodiment 7.
Test case 1 electrostatic detection
Contact with the glass stick after friction the Eliquis crystal formation that various embodiment 3 and comparative example 1-4 obtain respectively, observe whether static electrification, the results are shown in Table 1.
The electrostatic detection result of each crystal formation of table 1 Eliquis
Crystal formation type Embodiment 3 Comparative example 1 Comparative example 2 Comparative example 3 Comparative example 4
Electrostatic Nothing Nothing Nothing Nothing Have
Test case 2DSC collection of illustrative plates
Measure the DSC collection of illustrative plates of the Eliquis crystal formation of embodiment 3 and comparative example 1-4 acquisition respectively, the results are shown in Figure 2 and Fig. 9,10,8,7.
The DSC collection of illustrative plates display of the Eliquis crystal formation FA-2 of comparative example 1 Eliquis crystal formation DMF-5 and comparative example 2, the Eliquis crystal formation DMF-5 of the comparative example 1 and Eliquis crystal formation FA-2 of comparative example 2 is respectively at DMF(N, dinethylformamide) and FA(methane amide) there is a broad peak near boiling point, see Fig. 9-10, prove that it contains solvent DMF and FA, and DMF(boiling point 153 DEG C) and methane amide (boiling point 210 DEG C) boiling point high, be not easy to be removed by drying.
The DSC collection of illustrative plates display of comparative example 3 Eliquis crystal formation H2-2, except having except endotherm(ic)peak at 235 ~ 242 DEG C, having different heat absorption and release peaks respectively, seeing Fig. 8, prove that it is stable not before 200 DEG C.
And the DSC collection of illustrative plates display of the Eliquis crystal form A of the embodiment of the present invention 3 gained, it only has 235 ~ 242 DEG C of fusing endotherm(ic)peaks, and maximum heat absorption melt temperature is about 238 DEG C, other positions do not find any heat absorption and release peak, prove that it is stablized, not sticky solvent and water, do not occur to turn brilliant, see Fig. 2.
Test case 3 Detection of Stability
The Eliquis crystal formation of embodiment 3 gained is placed in illumination, high temperature or high humidity environment respectively, within 6 days, is DSC respectively after placement and detects.
Test condition is:
Illumination condition: exposure intensity 5000Lux;
Hot conditions: temperature 60 C;
The saturated potassium nitrate solution of super-humid conditions: humidity 95%(), temperature 25 DEG C.
Result shows:
The Eliquis crystal form A of embodiment 3 place 0 day consistent with the DSC spectrogram placing 6 days, as Fig. 4-6, there is no the moisture absorption, any change do not occur, prove at its stable crystal form of this condition.
The above; be only the specific embodiment of the present invention; but protection scope of the present invention is not limited thereto; any those of ordinary skill in the art are in disclosed technical scope; the change can expected without creative work or replacement, all should be encompassed within protection scope of the present invention.

Claims (10)

1. an Eliquis crystal form A, is characterized in that: its X-ray powder diffraction pattern is that 12.84 ± 0.2 °, 13.90 ± 0.2 °, 16.96 ± 0.2 °, 18.44 ± 0.2 °, 19.56 ± 0.2 ° and 32.74 ± 0.2 ° of places have characteristic peak at 2 θ.
2. Eliquis crystal form A as claimed in claim 1, is characterized in that: have XRPD collection of illustrative plates as shown in Figure 1 substantially.
3. Eliquis crystal form A as claimed in claim 1, is characterized in that: its DSC collection of illustrative plates has 235 ~ 242 DEG C of fusing endotherm(ic)peaks.
4. Eliquis crystal form A as claimed in claim 3, is characterized in that: have DSC collection of illustrative plates as shown in Figure 2 substantially.
5. Eliquis crystal form A as claimed in claim 1, is characterized in that: have IR collection of illustrative plates as shown in Figure 3 substantially.
6. the preparation method of Eliquis crystal form A according to any one of claim 1-5, it comprises the steps:
(1) in room temperature under solvent boiling point temperature condition, Eliquis solid is joined in the organic solvent of 5 ~ 200 times of volume/weight ratio and dissolves;
(2) at 0 ~ 150 DEG C, in step (1) gained solution, add the crystal seed of Eliquis crystal form A, be cooled to 0 ~ 30 DEG C, stir 0 ~ 48h, obtain suspension liquid;
(3) solid is separated from suspension liquid;
(4) solid drying will be separated, obtains Eliquis crystal form A;
Wherein, the crystal seed of step (2) described Eliquis crystal form A is prepared by following method:
(2.1) in room temperature under solvent boiling point temperature condition, Eliquis solid is joined in the organic solvent of 5 ~ 400 times of volume/weight ratio and dissolves;
(2.2) after solvent boiling point is incubated 0.5 hour ~ 10 hours, solution is slowly cooled to 0 ~ 30 DEG C, obtain a kind of suspension liquid;
(2.3) solid is separated from suspension liquid;
(2.4) by be separated solid 30 ~ 60 DEG C of dryings, obtain the crystal seed of Eliquis crystal form A.
7. preparation method as claimed in claim 6, it is characterized in that: described step (1) and the organic solvent described in step (2.1) independently be selected from one in methyl tertiary butyl ether, ether, isopropyl ether, methyl-formiate, butyl formate, ethyl acetate, methyl acetate, butylacetate, acetone, butanone, methyl alcohol, ethanol, propyl alcohol, Virahol, butanols or its mixture, be preferably one or several the mixture in methyl tertiary butyl ether, ether, acetone, ethyl acetate, methyl alcohol, ethanol, Virahol.
8. preparation method as claimed in claim 6, is characterized in that: 1 ~ 50% of the weight that the weight adding the crystal seed of Eliquis crystal form A in described step (2) is the Eliquis described in step (1), the crystal seed of Eliquis crystal form A is not completely dissolved.
9. preparation method as claimed in claim 6, is characterized in that: the method for the separation described in described step (3) comprises filtration, and washs with step (1) described organic solvent.
10. preparation method as claimed in claim 6, is characterized in that: the method for the separation described in described step (2.3) comprises filtration, and washs with step (2.1) described organic solvent.
CN201310349409.XA 2013-08-12 2013-08-12 Apixaban novel crystal form and preparation method thereof Pending CN104370902A (en)

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WO2021056850A1 (en) * 2019-09-26 2021-04-01 浙江天宇药业股份有限公司 Eutectic crystal formed by apixaban and carboxylic acid, and preparation method therefor

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