N-{5-[2-(4-methoxybenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}-4-methylbenzamide
Chemical Structure Depiction of
N-{5-[2-(4-methoxybenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}-4-methylbenzamide
N-{5-[2-(4-methoxybenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}-4-methylbenzamide
Compound characteristics
| Compound ID: | 3180-0052 |
| Compound Name: | N-{5-[2-(4-methoxybenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}-4-methylbenzamide |
| Molecular Weight: | 417.5 |
| Molecular Formula: | C19 H19 N3 O4 S2 |
| Smiles: | Cc1ccc(cc1)C(Nc1nnc(CCS(c2ccc(cc2)OC)(=O)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4077 |
| logD: | 2.5848 |
| logSw: | -3.7839 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.678 |
| InChI Key: | ZLARRGKFTPWCRU-UHFFFAOYSA-N |