HIT ID: HIT218847970
Cas No: 2931499-82-8
分子式: C29H24ClF3N6O5
分子量: 628.99
常用名: EGFR/HER2-IN-10
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: N-{3-chloro-4-[3-(trifluoromethyl)phenoxy]phenyl}-7-methoxy-6-[4-(2-nitro-1H-imidazol-1-yl)butoxy]quinazolin-4-amine
IUPAC: N-{3-chloro-4-[3-(trifluoromethyl)phenoxy]phenyl}-7-methoxy-6-[4-(2-nitro-1H-imidazol-1-yl)butoxy]quinazolin-4-amine
SMILES: COc1cc2ncnc(Nc3ccc(Oc4cccc(c4)C(F)(F)F)c(Cl)c3)c2cc1OCCCCn1ccnc1[N+]([O-])=O
SMILES: COc1cc2ncnc(Nc3ccc(Oc4cccc(c4)C(F)(F)F)c(Cl)c3)c2cc1OCCCCn1ccnc1[N+]([O-])=O
InChI key: OWTCMGIQRBBCSW-UHFFFAOYSA-N
