PF-06456384
HIT212713316
sdf文件结构编辑类似物检索
HIT ID: HIT212713316
Cas No: 1834610-73-9
分子式: C35H32F3N7O3S2
分子量: 719.8
常用名: PF-06456384
氢键受体数 (HBA): 8
氢键供体数 (HBD): 3
LogP: 4.8701754
IUPAC: 3-cyano-4-({3-[2-({[2-(piperidin-4-yl)ethyl]amino}methyl)pyridin-4-yl]-3'-(trifluoromethyl)-[1,1'-biphenyl]-4-yl}oxy)-N-(1,2,4-thiadiazol-5-yl)benzene-1-sulfonamide
IUPAC: 3-cyano-4-({3-[2-({[2-(piperidin-4-yl)ethyl]amino}methyl)pyridin-4-yl]-3'-(trifluoromethyl)-[1,1'-biphenyl]-4-yl}oxy)-N-(1,2,4-thiadiazol-5-yl)benzene-1-sulfonamide
SMILES: FC(F)(F)c1cccc(c1)-c1ccc(Oc2ccc(cc2C#N)S(=O)(=O)Nc2ncns2)c(c1)-c1ccnc(CNCCC2CCNCC2)c1
SMILES: FC(F)(F)c1cccc(c1)-c1ccc(Oc2ccc(cc2C#N)S(=O)(=O)Nc2ncns2)c(c1)-c1ccnc(CNCCC2CCNCC2)c1
InChI key: WSPHMGORSRQULF-UHFFFAOYSA-N
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