2-{[5-(5-ethylthiophen-3-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
2-{[5-(5-ethylthiophen-3-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
2-{[5-(5-ethylthiophen-3-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y202-9305 |
| Compound Name: | 2-{[5-(5-ethylthiophen-3-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 308.42 |
| Molecular Formula: | C13 H16 N4 O S2 |
| Smiles: | CCc1cc(cs1)c1nnc(n1CC=C)SCC(N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2958 |
| logD: | 2.2958 |
| logSw: | -2.3093 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.897 |
| InChI Key: | HJNTYFYYKHEFSJ-UHFFFAOYSA-N |