N-(4-chlorophenyl)-5-(1-{[2-(trifluoromethyl)phenyl]carbamoyl}pyrrolidin-2-yl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-5-(1-{[2-(trifluoromethyl)phenyl]carbamoyl}pyrrolidin-2-yl)-1,3,4-thiadiazole-2-carboxamide
N-(4-chlorophenyl)-5-(1-{[2-(trifluoromethyl)phenyl]carbamoyl}pyrrolidin-2-yl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F793-0196 |
| Compound Name: | N-(4-chlorophenyl)-5-(1-{[2-(trifluoromethyl)phenyl]carbamoyl}pyrrolidin-2-yl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 495.91 |
| Molecular Formula: | C21 H17 Cl F3 N5 O2 S |
| Smiles: | C1CC(c2nnc(C(Nc3ccc(cc3)[Cl])=O)s2)N(C1)C(Nc1ccccc1C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6629 |
| logD: | 4.6602 |
| logSw: | -5.0055 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.393 |
| InChI Key: | JUSFMTLGYFTBNB-INIZCTEOSA-N |