N-(4-chlorophenyl)-5-[1-(4-ethylbenzene-1-sulfonyl)pyrrolidin-2-yl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-5-[1-(4-ethylbenzene-1-sulfonyl)pyrrolidin-2-yl]-1,3,4-thiadiazole-2-carboxamide
N-(4-chlorophenyl)-5-[1-(4-ethylbenzene-1-sulfonyl)pyrrolidin-2-yl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F794-0138 |
| Compound Name: | N-(4-chlorophenyl)-5-[1-(4-ethylbenzene-1-sulfonyl)pyrrolidin-2-yl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 477 |
| Molecular Formula: | C21 H21 Cl N4 O3 S2 |
| Smiles: | CCc1ccc(cc1)S(N1CCCC1c1nnc(C(Nc2ccc(cc2)[Cl])=O)s1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5545 |
| logD: | 4.5507 |
| logSw: | -4.5951 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.11 |
| InChI Key: | YRNKTMALEHXSCT-SFHVURJKSA-N |