HIT ID: HIT212037676
Cas No: 524722-52-9
分子式: C22H25BrClFN4O2
分子量: 511.82
常用名: Vandetanib hydrochloride
氢键受体数 (HBA): 6
氢键供体数 (HBD): 1
LogP: 4.542965
IUPAC: N-(4-bromo-2-fluorophenyl)-6-methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinazolin-4-amine hydrochloride
IUPAC: N-(4-bromo-2-fluorophenyl)-6-methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinazolin-4-amine hydrochloride
SMILES: Cl.COc1cc2c(Nc3ccc(Br)cc3F)ncnc2cc1OCC1CCN(C)CC1
SMILES: Cl.COc1cc2c(Nc3ccc(Br)cc3F)ncnc2cc1OCC1CCN(C)CC1
InChI key: KVBQCJXMSFJOFP-UHFFFAOYSA-N
