N-(3-chlorophenyl)-5-[1-(4-ethylbenzene-1-sulfonyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-[1-(4-ethylbenzene-1-sulfonyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-[1-(4-ethylbenzene-1-sulfonyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L078-0294 |
| Compound Name: | N-(3-chlorophenyl)-5-[1-(4-ethylbenzene-1-sulfonyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 491.03 |
| Molecular Formula: | C22 H23 Cl N4 O3 S2 |
| Smiles: | CCc1ccc(cc1)S(N1CCC(CC1)c1nnc(C(Nc2cccc(c2)[Cl])=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1272 |
| logD: | 5.1239 |
| logSw: | -5.4299 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.273 |
| InChI Key: | ABJAOOSRJLSSRW-UHFFFAOYSA-N |