Apixaban Impurity 9

Basic Information

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CAS Number

503614-91-3

Molecular Formula

C27H28N4O5

Molecular Weight

488.54 g/mol

Basic Physical Properties

Boiling Point

758.7±60.0°C at 760 mmHg

Density

1.34

SMILES

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O=C(C1=NN(C2=CC=C(OC)C=C2)C3=C1CCN(C4=CC=C(N5C(CCCC5)=O)C=C4)C3=O)OCC

InChI

InChI=1S/C27H28N4O5/c1-3-36-27(34)24-22-15-17-30(19-9-7-18(8-10-19)29-16-5-4-6-23(29)32)26(33)25(22)31(28-24)20-11-13-21(35-2)14-12-20/h7-14H,3-6,15-17H2,1-2H3

InChIKey

PULNLYVCJSOXKS-UHFFFAOYSA-N

LogP

3.7774000000000028

Topological Polar Surface Area

93.97000000000001 Å²

Hydrogen Bond Donor/Acceptor

0 / 9

Complexity

808

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

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 ethyl ester
BMS-589149-01
1H-Pyrazolo[3,4-c]pyridine-3-carboxylicacid,4,5,6,7-tetrahydro-1-(4-Methoxyphenyl)-7-oxo-6-[4-(2-oxo-1-piperidinyl)phenyl]-,ethylester
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 ethyl ester
Apixaba inretMediate C
ethyl 1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylate
Apixaban Impurity 7
-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylate
-7-oxo-6-(4-(2-oxopiperidin-1-yl)
Ethyl 1-(4-methoxyphenyl)
Apixaban V
Ethyl 1-(4-methoxyphenyl)-7-oxo-6-(4-(2-oxopiperidin-1-yl)phenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carbo...
ethyl 1-(4-methoxyphenyl)-7-oxo-6-(4-(2-oxopiperidin-1-yl)phenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylate
1-(4-methoxy-phenyl)-7-oxo-6-[4-(2-oxo-piperidin-1-yl)-phenyl]-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylic acid ethyl ester
AB1008473
AK-93370
ethyl 1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxo-1-piperidin-1-yl)phenyl]-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylate
Ethyl1-(4-Methoxyphenyl)-7-oxo-6-(4-(2-oxopiperidin-1-yl)phenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylate
Ethyl 1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5,6,7-tetrahydro-1H-pyra
CID 22240488
Ethyl 1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c
Ethyl 1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxo-1-piperidinyl)phenyl]-4,5,6,7-tetrahydro-1H-pyrazolo[3,4
Apixaban Impurity 9 （BMS-589149-01）

MDL Number

MFCD18072444

FAQ

What is Apixaban Impurity 9 (CAS: 503614-91-3)?

Apixaban Impurity 9 is a by-product of the synthesis of apixaban, a direct oral anticoagulant used to prevent and treat venous thromboembolism. It is a minor impurity with a specific chemical structure but does not have therapeutic value on its own. Its chemical formula is not typically specified but it is known to have similar characteristics to apixaban, including a molecular weight of approximately 414.13 g/mol.

What are the main uses of Apixaban Impurity 9 (CAS: 503614-91-3)?

Apixaban Impurity 9 is primarily used in quality control and as a reference standard in the pharmaceutical industry to ensure the purity of apixaban. It is not used for therapeutic purposes and its presence is monitored to ensure the safety and efficacy of apixaban medications.

Is Apixaban Impurity 9 (CAS: 503614-91-3) safe?

Apixaban Impurity 9 is generally considered safe for laboratory handling under appropriate precautions. It is not acutely toxic, but handling should be done in a well-ventilated area and with proper personal protective equipment (PPE) such as gloves and goggles. It is important to follow the Material Safety Data Sheet (MSDS) guidelines provided by the supplier.

How should Apixaban Impurity 9 (CAS: 503614-91-3) be stored?

Apixaban Impurity 9 should be stored in a cool, dry place away from direct sunlight and sources of heat. It is recommended to store it at room temperature (15-25°C) and avoid exposure to moisture. The impurity should be kept in a tightly sealed container to prevent degradation. It is also advisable to keep it away from incompatible materials such as strong acids and bases.