HIT ID: HIT218848279
Cas No: 2849338-41-4
分子式: C24H16F6N4O4
分子量: 538.406
常用名: HSD17B13-IN-95
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 5-hydroxy-N-(4-oxo-3-{2-[2-(trifluoromethoxy)phenyl]ethyl}-3,4-dihydroquinazolin-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide
IUPAC: 5-hydroxy-N-(4-oxo-3-{2-[2-(trifluoromethoxy)phenyl]ethyl}-3,4-dihydroquinazolin-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide
SMILES: Oc1ccc(nc1C(F)(F)F)C(=O)Nc1cccc2ncn(CCc3ccccc3OC(F)(F)F)c(=O)c12
SMILES: Oc1ccc(nc1C(F)(F)F)C(=O)Nc1cccc2ncn(CCc3ccccc3OC(F)(F)F)c(=O)c12
InChI key: SPPSPRQAEXJVFI-UHFFFAOYSA-N
