HIT ID: HIT212672837
Cas No: 1029317-21-2
分子式: C22H23N3O2S
分子量: 393.51
常用名: PF-4191834
氢键受体数 (HBA): 3
氢键供体数 (HBD): 1
LogP: 3.2643716
IUPAC: 4-(3-{[4-(1-methyl-1H-pyrazol-5-yl)phenyl]sulfanyl}phenyl)oxane-4-carboxamide
IUPAC: 4-(3-{[4-(1-methyl-1H-pyrazol-5-yl)phenyl]sulfanyl}phenyl)oxane-4-carboxamide
SMILES: Cn1nccc1-c1ccc(Sc2cccc(c2)C2(CCOCC2)C(N)=O)cc1
SMILES: Cn1nccc1-c1ccc(Sc2cccc(c2)C2(CCOCC2)C(N)=O)cc1
InChI key: DVNQWYLVSNPCJZ-UHFFFAOYSA-N