N-(3,4-difluorophenyl)-5-(1-{[3-(methylsulfanyl)phenyl]carbamoyl}pyrrolidin-2-yl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3,4-difluorophenyl)-5-(1-{[3-(methylsulfanyl)phenyl]carbamoyl}pyrrolidin-2-yl)-1,3,4-thiadiazole-2-carboxamide
N-(3,4-difluorophenyl)-5-(1-{[3-(methylsulfanyl)phenyl]carbamoyl}pyrrolidin-2-yl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F793-1458 |
| Compound Name: | N-(3,4-difluorophenyl)-5-(1-{[3-(methylsulfanyl)phenyl]carbamoyl}pyrrolidin-2-yl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 475.54 |
| Molecular Formula: | C21 H19 F2 N5 O2 S2 |
| Smiles: | CSc1cccc(c1)NC(N1CCCC1c1nnc(C(Nc2ccc(c(c2)F)F)=O)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9741 |
| logD: | 3.8058 |
| logSw: | -4.0209 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.091 |
| InChI Key: | ZIBYTTZCLQTBFY-KRWDZBQOSA-N |