HIT ID: HIT218909539
Cas No: 2543763-00-2
分子式: C24H27F3N6O
分子量: 472.516
常用名: EGFR-IN-123
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: N4-(3-methoxyphenyl)-N6-{4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl}pyrimidine-4,6-diamine
IUPAC: N4-(3-methoxyphenyl)-N6-{4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl}pyrimidine-4,6-diamine
SMILES: COc1cccc(Nc2cc(Nc3ccc(CN4CCN(C)CC4)c(c3)C(F)(F)F)ncn2)c1
SMILES: COc1cccc(Nc2cc(Nc3ccc(CN4CCN(C)CC4)c(c3)C(F)(F)F)ncn2)c1
InChI key: JWHOTQWEKXOWHS-UHFFFAOYSA-N