3-methoxy-N-{5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
3-methoxy-N-{5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide
3-methoxy-N-{5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | V014-6545 |
| Compound Name: | 3-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: | COc1cccc(c1)C(Nc1nnc(SCC=C)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7706 |
| logD: | 3.759 |
| logSw: | -4.0256 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.779 |
| InChI Key: | MZZUATRSQZXASN-UHFFFAOYSA-N |