N-{5-[(benzenesulfonyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methoxy-4-(methylsulfanyl)benzamide
Chemical Structure Depiction of
N-{5-[(benzenesulfonyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methoxy-4-(methylsulfanyl)benzamide
N-{5-[(benzenesulfonyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methoxy-4-(methylsulfanyl)benzamide
Compound characteristics
| Compound ID: | Y031-3235 |
| Compound Name: | N-{5-[(benzenesulfonyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methoxy-4-(methylsulfanyl)benzamide |
| Molecular Weight: | 435.54 |
| Molecular Formula: | C18 H17 N3 O4 S3 |
| Smiles: | COc1cc(ccc1C(Nc1nnc(CS(c2ccccc2)(=O)=O)s1)=O)SC |
| Stereo: | ACHIRAL |
| logP: | 3.267 |
| logD: | 1.443 |
| logSw: | -3.7615 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.765 |
| InChI Key: | HDUYDYQYVBVNHV-UHFFFAOYSA-N |