HIT ID: HIT219137028
Cas No: 1000599-06-3
分子式: C31H33Cl2FN4O5S
分子量: 663.59
常用名: Tesevatinib tosylate
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 4-methylbenzene-1-sulfonic acid; 7-{[(3aR,5S,6aS)-2-methyl-octahydrocyclopenta[c]pyrrol-5-yl]methoxy}-N-(3,4-dichloro-2-fluorophenyl)-6-methoxyquinazolin-4-amine
IUPAC: 4-methylbenzene-1-sulfonic acid; 7-{[(3aR,5S,6aS)-2-methyl-octahydrocyclopenta[c]pyrrol-5-yl]methoxy}-N-(3,4-dichloro-2-fluorophenyl)-6-methoxyquinazolin-4-amine
SMILES: Cc1ccc(cc1)S(O)(=O)=O.[H][C@@]12C[C@H](COc3cc4ncnc(Nc5ccc(Cl)c(Cl)c5F)c4cc3OC)C[C@]1([H])CN(C)C2
SMILES: Cc1ccc(cc1)S(O)(=O)=O.[H][C@@]12C[C@H](COc3cc4ncnc(Nc5ccc(Cl)c(Cl)c5F)c4cc3OC)C[C@]1([H])CN(C)C2
InChI key: GQLLAIBEWDUUBQ-QIYAQLFNSA-N
