5-[1-(4-cyanobenzoyl)pyrrolidin-2-yl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[1-(4-cyanobenzoyl)pyrrolidin-2-yl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-[1-(4-cyanobenzoyl)pyrrolidin-2-yl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F792-0413 |
| Compound Name: | 5-[1-(4-cyanobenzoyl)pyrrolidin-2-yl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 421.45 |
| Molecular Formula: | C21 H16 F N5 O2 S |
| Smiles: | C1CC(c2nnc(C(Nc3ccc(cc3)F)=O)s2)N(C1)C(c1ccc(C#N)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6765 |
| logD: | 2.6738 |
| logSw: | -3.1423 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.327 |
| InChI Key: | NFMIFNPGAIEAKD-KRWDZBQOSA-N |