HIT ID: HIT212034075
Cas No: 404844-02-6
分子式: C28H29N7O
分子量: 479.588
常用名: N-Desmethyl imatinib
氢键受体数 (HBA): 7
氢键供体数 (HBD): 3
LogP: 3.994625
IUPAC: N-(4-methyl-3-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}phenyl)-4-[(piperazin-1-yl)methyl]benzamide
IUPAC: N-(4-methyl-3-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}phenyl)-4-[(piperazin-1-yl)methyl]benzamide
SMILES: Cc1ccc(NC(=O)c2ccc(CN3CCNCC3)cc2)cc1Nc1nccc(n1)-c1cccnc1
SMILES: Cc1ccc(NC(=O)c2ccc(CN3CCNCC3)cc2)cc1Nc1nccc(n1)-c1cccnc1
InChI key: BQQYXPHRXIZMDM-UHFFFAOYSA-N
