4-methyl-N-{5-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
4-methyl-N-{5-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide
4-methyl-N-{5-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | 1937-0305 |
| Compound Name: | 4-methyl-N-{5-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide |
| Molecular Weight: | 401.5 |
| Molecular Formula: | C19 H19 N3 O3 S2 |
| Smiles: | Cc1ccc(cc1)C(Nc1nnc(CCS(c2ccc(C)cc2)(=O)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8488 |
| logD: | 3.0258 |
| logSw: | -3.9571 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.135 |
| InChI Key: | AUPZZTPHUFYHJA-UHFFFAOYSA-N |