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Apixaban-[13C,d3]

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General Information
Catalog: BLP-011787
CAS: 1261393-15-0
Molecular Formula: C24[13C]H22D3N5O4
Molecular Weight: 463.52

Chemical Structure

Description	Apixaban-[13C,d3] is the labelled analogue of Apixaban. Apixaban is an anticoagulant for the prevention of venous thromboembolism and the prevention of stroke in atrial fibrillation. It is a direct factor Xa inhibitor.
Synonyms	Apixaban-13C,D3; 4,5,6,7-Tetrahydro-1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxo-1-piperidinyl)phenyl]-1H-pyrazolo[3,4-c]pyridine-3-carboxamide-13C,d3; BMS 562247-01-13C,d3; 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 Amide-13C,d3; Eliquis-13C,d3
IUPAC Name	7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-1-[4-(trideuterio(1-13C)methoxy)phenyl]-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxamide
Related CAS	503612-47-3 (unlabelled)
Canonical SMILES	COC1=CC=C(C=C1)N2C3=C(CCN(C3=O)C4=CC=C(C=C4)N5CCCCC5=O)C(=N2)C(=O)N
InChI	InChI=1S/C25H25N5O4/c1-34-19-11-9-18(10-12-19)30-23-20(22(27-30)24(26)32)13-15-29(25(23)33)17-7-5-16(6-8-17)28-14-3-2-4-21(28)31/h5-12H,2-4,13-15H2,1H3,(H2,26,32)/i1+1D3
InChI Key	QNZCBYKSOIHPEH-KQORAOOSSA-N
Melting Point	235-237°C
Purity	≥96% by HPLC; 99% atom 13C; 99% atom D
Solubility	Soluble in DMSO (Slightly), Methanol (Slightly)
Appearance	White to Off-white Solid
Storage	Store at 2-8°C