N-(4-chlorophenyl)-5-[1-(3-cyanobenzene-1-sulfonyl)piperidin-3-yl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-5-[1-(3-cyanobenzene-1-sulfonyl)piperidin-3-yl]-1,3,4-thiadiazole-2-carboxamide
N-(4-chlorophenyl)-5-[1-(3-cyanobenzene-1-sulfonyl)piperidin-3-yl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L066-0118 |
| Compound Name: | N-(4-chlorophenyl)-5-[1-(3-cyanobenzene-1-sulfonyl)piperidin-3-yl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 487.99 |
| Molecular Formula: | C21 H18 Cl N5 O3 S2 |
| Smiles: | C1CC(CN(C1)S(c1cccc(C#N)c1)(=O)=O)c1nnc(C(Nc2ccc(cc2)[Cl])=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5409 |
| logD: | 3.5382 |
| logSw: | -4.1154 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.263 |
| InChI Key: | QWRPDLCBESJJFP-HNNXBMFYSA-N |