2-{[5-(4-ethyl-5-methylthiophen-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
2-{[5-(4-ethyl-5-methylthiophen-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
2-{[5-(4-ethyl-5-methylthiophen-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y205-9179 |
| Compound Name: | 2-{[5-(4-ethyl-5-methylthiophen-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 296.41 |
| Molecular Formula: | C12 H16 N4 O S2 |
| Smiles: | CCc1c(csc1C)c1nnc(n1C)SCC(N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8576 |
| logD: | 1.8575 |
| logSw: | -2.1742 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.729 |
| InChI Key: | AIAAOYZHYIQSNT-UHFFFAOYSA-N |