5-[1-(3-chloro-2-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]-N-(2,4-difluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[1-(3-chloro-2-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]-N-(2,4-difluorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-[1-(3-chloro-2-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]-N-(2,4-difluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F794-1041 |
| Compound Name: | 5-[1-(3-chloro-2-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]-N-(2,4-difluorophenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 498.96 |
| Molecular Formula: | C20 H17 Cl F2 N4 O3 S2 |
| Smiles: | Cc1c(cccc1[Cl])S(N1CCCC1c1nnc(C(Nc2ccc(cc2F)F)=O)s1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.023 |
| logD: | 3.7977 |
| logSw: | -4.2567 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.412 |
| InChI Key: | ZCALULVYIWNAMB-INIZCTEOSA-N |