2-{[5-(5-methylthiophen-3-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
2-{[5-(5-methylthiophen-3-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
2-{[5-(5-methylthiophen-3-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y205-9834 |
| Compound Name: | 2-{[5-(5-methylthiophen-3-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 294.39 |
| Molecular Formula: | C12 H14 N4 O S2 |
| Smiles: | Cc1cc(cs1)c1nnc(n1CC=C)SCC(N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9274 |
| logD: | 1.9274 |
| logSw: | -2.0545 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.897 |
| InChI Key: | CBFIXXNOFOZHNK-UHFFFAOYSA-N |