Apixaban acid

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H24N4O5
Molecular Weight	460.4819
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC=C(C=C1)N2N=C(C(O)=O)C3=C2C(=O)N(CC3)C4=CC=C(C=C4)N5CCCCC5=O

InChI

InChIKey=PPUHOTDYJQGTAE-UHFFFAOYSA-N

InChI=1S/C25H24N4O5/c1-34-19-11-9-18(10-12-19)29-23-20(22(26-29)25(32)33)13-15-28(24(23)31)17-7-5-16(6-8-17)27-14-3-2-4-21(27)30/h5-12H,2-4,13-15H2,1H3,(H,32,33)

HIDE SMILES / InChI

Molecular Formula	C25H24N4O5
Molecular Weight	460.4819
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 16:15:48 GMT 2025` Edited by `admin` on `Wed Apr 02 16:15:48 GMT 2025`
Record UNII	VKR3573LDM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Apixaban Acid Impurity

Preferred Name

English

Apixaban acid

Common Name

English

1H-Pyrazolo[3,4-c]pyridine-3-carboxylic acid, 4,5,6,7-tetrahydro-1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxo-1-piperidinyl)phenyl]-

Systematic Name

English

1-(4-Methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylic acid

Systematic Name

English

Apixaban acid [USP IMPURITY]

Common Name

English

Apixaban carboxylic acid impurity

Common Name

English

4,5,6,7-Tetrahydro-1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxo-1-piperidinyl)phenyl]-1H-pyrazolo[3,4-c]pyridine-3-carboxylic acid

Systematic Name

English

Apixaban carboxylic acid

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID70623725

Created by admin on Wed Apr 02 16:15:48 GMT 2025 , Edited by admin on Wed Apr 02 16:15:48 GMT 2025

PRIMARY

FDA UNII

VKR3573LDM

Created by admin on Wed Apr 02 16:15:48 GMT 2025 , Edited by admin on Wed Apr 02 16:15:48 GMT 2025

PRIMARY

CAS

503614-92-4

Created by admin on Wed Apr 02 16:15:48 GMT 2025 , Edited by admin on Wed Apr 02 16:15:48 GMT 2025

PRIMARY

PUBCHEM

22240440

Created by admin on Wed Apr 02 16:15:48 GMT 2025 , Edited by admin on Wed Apr 02 16:15:48 GMT 2025

PRIMARY

Related Record Type Details


					XT6BDS8H67

Potassium 1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxo-1-piperidinyl)phenyl]-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylate

SALT/SOLVATE -> PARENT

Amount:

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					3Z9Y7UWC1J

APIXABAN

PARENT -> IMPURITY

Amount: