HIT ID: HIT214433329
Cas No: 2701563-03-1
分子式: C32H36FN7O2
分子量: 569.685
常用名: EGFR-IN-31
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: N-(2-{[2-(dimethylamino)ethyl](methyl)amino}-5-{[5-(4-fluorophenyl)-4-[(4-methylphenyl)amino]pyrimidin-2-yl]amino}-4-methoxyphenyl)prop-2-enamide
IUPAC: N-(2-{[2-(dimethylamino)ethyl](methyl)amino}-5-{[5-(4-fluorophenyl)-4-[(4-methylphenyl)amino]pyrimidin-2-yl]amino}-4-methoxyphenyl)prop-2-enamide
SMILES: COc1cc(N(C)CCN(C)C)c(NC(=O)C=C)cc1Nc1ncc(c(Nc2ccc(C)cc2)n1)-c1ccc(F)cc1
SMILES: COc1cc(N(C)CCN(C)C)c(NC(=O)C=C)cc1Nc1ncc(c(Nc2ccc(C)cc2)n1)-c1ccc(F)cc1
InChI key: LTHVDNXRWSAVNX-UHFFFAOYSA-N
