Name: Venetoclax-D8
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HIT ID:HIT218701082
Cas No:1257051-06-1
Common Name:Venetoclax-D8
alias:RG7601-d8, RG 7601-d8, GDC0199-d8, GDC-0199-d8, ABT199-d8, ABT-199-d8
alias:RG7601-d8, RG 7601-d8, GDC0199-d8, GDC-0199-d8, ABT199-d8, ABT-199-d8
IUPAC:4-(4-{[2-(4-chlorophenyl)-4,4-dimethylcyclohex-1-en-1-yl]methyl}(2,2,3,3,5,5,6,6-2H8)piperazin-1-yl)-N-(3-nitro-4-{[(oxan-4-yl)methyl]amino}benzenesulfonyl)-2-{1H-pyrrolo[2,3-b]pyridin-5-yloxy}benzamide
IUPAC:4-(4-{[2-(4-chlorophenyl)-4,4-dimethylcyclohex-1-en-1-yl]methyl}(2,2,3,3,5,5,6,6-2H8)piperazin-1-yl)-N-(3-nitro-4-{[(oxan-4-yl)methyl]amino}benzenesulfonyl)-2-{1H-pyrrolo[2,3-b]pyridin-5-yloxy}benzamide
InChI key:LQBVNQSMGBZMKD-JYSKPPGCSA-N

Molecular Formula:C45H50ClN7O7S
Molecular Weight:876.5
Hydrogen Bond Donor (HBD):
Hydrogen Bond Acceptor (HBA):
LogP:
SMILES:[2H]C1([2H])N(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)C([2H])([2H])C([2H])([2H])N(c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)N(=O)=O)c(Oc3cnc4[nH]ccc4c3)c2)C1([2H])[2H]
SMILES:[2H]C1([2H])N(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)C([2H])([2H])C([2H])([2H])N(c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)N(=O)=O)c(Oc3cnc4[nH]ccc4c3)c2)C1([2H])[2H]

Venetoclax-D8 is a deuterated form of Venetoclax (<a style="color:#E14C54" href="/compound/venetoclax">T2119</a>), a potent, selective, and orally active Bcl-2 inhibitor that induces autophagy and apoptosis.

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