2-{[5-(4-ethyl-5-methylthiophen-3-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
2-{[5-(4-ethyl-5-methylthiophen-3-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
2-{[5-(4-ethyl-5-methylthiophen-3-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y205-6684 |
| Compound Name: | 2-{[5-(4-ethyl-5-methylthiophen-3-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 324.46 |
| Molecular Formula: | C14 H20 N4 O S2 |
| Smiles: | CCc1c(csc1C)c1nnc(n1C(C)C)SCC(N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7343 |
| logD: | 2.7335 |
| logSw: | -2.9353 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.994 |
| InChI Key: | PMZPQKSEHXMKKB-UHFFFAOYSA-N |