Products 2270190-88-8

CAS 2270190-88-8 appears in our catalog under these names: Venetoclax Impurity 17, Venetoclax Impurity 3, Venetoclax Impurity S2B, VNL7-VNL5 (Venetoclax Dimer Impurity 2). Offered by: Chemat Brand, TRC. Available pack sizes: on request, 50mg, 250mg.

Structural formula: {0} (CAS {1})

4-[4-[[2-(4-chlorophenyl)-4,4-dimethylcyclohexen-1-yl]methyl]piperazin-1-yl]-2-[1-[4-[4-[[2-(4-chlorophenyl)-4,4-dimethylcyclohexen-1-yl]methyl]piperazin-1-yl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoyl]pyrrolo[2,3-b]pyridin-5-yl]oxy-N-[3-nitro-4-(oxan-4-ylmethylamino)phenyl]sulfonylbenzamide (CAS 2270190-88-8) is a chemical compound with the molecular formula C78H83Cl2N11O9S and a molecular weight of 1421.5 g/mol. IUPAC name: 4-[4-[[2-(4-chlorophenyl)-4,4-dimethylcyclohexen-1-yl]methyl]piperazin-1-yl]-2-[1-[4-[4-[[2-(4-chlorophenyl)-4,4-dimethylcyclohexen-1-yl]methyl]piperazin-1-yl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoyl]pyrrolo[2,3-b]pyridin-5-yl]oxy-N-[3-nitro-4-(oxan-4-ylmethylamino)phenyl]sulfonylbenzamide. InChIKey: KZRJVBYNDFMXPA-UHFFFAOYSA-N.

Identity
Molecular formulaC78H83Cl2N11O9S
Molecular weight1421.5 g/mol
IUPAC name4-[4-[[2-(4-chlorophenyl)-4,4-dimethylcyclohexen-1-yl]methyl]piperazin-1-yl]-2-[1-[4-[4-[[2-(4-chlorophenyl)-4,4-dimethylcyclohexen-1-yl]methyl]piperazin-1-yl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoyl]pyrrolo[2,3-b]pyridin-5-yl]oxy-N-[3-nitro-4-(oxan-4-ylmethylamino)phenyl]sulfonylbenzamide
InChIKeyKZRJVBYNDFMXPA-UHFFFAOYSA-N
SMILESCC1(CCC(=C(C1)C2=CC=C(C=C2)Cl)CN3CCN(CC3)C4=CC(=C(C=C4)C(=O)NS(=O)(=O)C5=CC(=C(C=C5)NCC6CCOCC6)[N+](=O)[O-])OC7=CN=C8C(=C7)C=CN8C(=O)C9=C(C=C(C=C9)N1CCN(CC1)CC1=C(CC(CC1)(C)C)C1=CC=C(C=C1)Cl)OC1=CN=C2C(=C1)C=CN2)C

Computed by PubChem (NCBI)