2-methoxy-N-{5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
2-methoxy-N-{5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide
2-methoxy-N-{5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | V010-1901 |
| Compound Name: | 2-methoxy-N-{5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide |
| Molecular Weight: | 307.39 |
| Molecular Formula: | C13 H13 N3 O2 S2 |
| Salt: | not_available |
| Smiles: | COc1ccccc1C(Nc1nnc(SCC=C)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5335 |
| logD: | 3.042 |
| logSw: | -3.8369 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.866 |
| InChI Key: | KBNXTPLMAOLUOE-UHFFFAOYSA-N |