2-(benzenesulfonyl)-N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}acetamide
Chemical Structure Depiction of
2-(benzenesulfonyl)-N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}acetamide
2-(benzenesulfonyl)-N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}acetamide
Compound characteristics
| Compound ID: | Y031-1789 |
| Compound Name: | 2-(benzenesulfonyl)-N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}acetamide |
| Molecular Weight: | 433.5 |
| Molecular Formula: | C19 H19 N3 O5 S2 |
| Smiles: | COc1ccc(Cc2nnc(NC(CS(c3ccccc3)(=O)=O)=O)s2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.2523 |
| logD: | 2.2224 |
| logSw: | -2.9563 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.182 |
| InChI Key: | VSMDOGZOBLYGGV-UHFFFAOYSA-N |