N-(3-chlorophenyl)-5-[1-(2-ethylbenzene-1-sulfonyl)piperidin-3-yl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-[1-(2-ethylbenzene-1-sulfonyl)piperidin-3-yl]-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-[1-(2-ethylbenzene-1-sulfonyl)piperidin-3-yl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L066-0406 |
| Compound Name: | N-(3-chlorophenyl)-5-[1-(2-ethylbenzene-1-sulfonyl)piperidin-3-yl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 491.03 |
| Molecular Formula: | C22 H23 Cl N4 O3 S2 |
| Smiles: | CCc1ccccc1S(N1CCCC(C1)c1nnc(C(Nc2cccc(c2)[Cl])=O)s1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7046 |
| logD: | 4.7013 |
| logSw: | -4.6457 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.206 |
| InChI Key: | PPPURUNBKPGZJY-INIZCTEOSA-N |