HIT ID: HIT212672781
Cas No: 1005168-10-4
分子式: C21H22F5N3O3S
分子量: 491.48
常用名: Asivatrep
氢键受体数 (HBA): 4
氢键供体数 (HBD): 2
LogP: 3.674912
IUPAC: (2E)-N-[(1R)-1-(3,5-difluoro-4-methanesulfonamidophenyl)ethyl]-3-[2-propyl-6-(trifluoromethyl)pyridin-3-yl]prop-2-enamide
IUPAC: (2E)-N-[(1R)-1-(3,5-difluoro-4-methanesulfonamidophenyl)ethyl]-3-[2-propyl-6-(trifluoromethyl)pyridin-3-yl]prop-2-enamide
SMILES: CCCc1nc(ccc1\C=C\C(=O)N[C@H](C)c1cc(F)c(NS(C)(=O)=O)c(F)c1)C(F)(F)F
SMILES: CCCc1nc(ccc1\C=C\C(=O)N[C@H](C)c1cc(F)c(NS(C)(=O)=O)c(F)c1)C(F)(F)F
InChI key: UKGJZDSUJSPAJL-YPUOHESYSA-N
