Name: Imatinib carbaldehyde
Rating: 5 (10 reviews)

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HIT ID:HIT212668241
Cas No:1436868-85-7
常用名:Imatinib carbaldehyde
别名:STI571 carbaldehyde, PROTAC ABL binding moiety 1, CGP-57148B carbaldehyde
别名:STI571 carbaldehyde, PROTAC ABL binding moiety 1, CGP-57148B carbaldehyde
IUPAC:4-[(4-formylpiperazin-1-yl)methyl]-N-(4-methyl-3-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}phenyl)benzamide
IUPAC:4-[(4-formylpiperazin-1-yl)methyl]-N-(4-methyl-3-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}phenyl)benzamide
InChI key:PFQIGKMFNNGGPR-UHFFFAOYSA-N

分子式:C29H29N7O2
分子量:507.598
氢键供体数 (HBD):2
氢键受体数 (HBA):7
LogP:3.5558686
SMILES:Cc1ccc(NC(=O)c2ccc(CN3CCN(CC3)C=O)cc2)cc1Nc1nccc(n1)-c1cccnc1
SMILES:Cc1ccc(NC(=O)c2ccc(CN3CCN(CC3)C=O)cc2)cc1Nc1nccc(n1)-c1cccnc1

Imatinib carbaldehyde (also known as CGP-57148B carbaldehyde) is a compound derived from Imatinib, an inhibitor of the ABL protein. Imatinib carbaldehyde binds to the IAP ligand with the assistance of a linker, resulting in the formation of SNIPER[1].

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