2-{[4-methyl-5-(5-methylthiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-phenylacetamide
Chemical Structure Depiction of
2-{[4-methyl-5-(5-methylthiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-phenylacetamide
2-{[4-methyl-5-(5-methylthiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-phenylacetamide
Compound characteristics
| Compound ID: | Y205-9847 |
| Compound Name: | 2-{[4-methyl-5-(5-methylthiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-phenylacetamide |
| Molecular Weight: | 344.46 |
| Molecular Formula: | C16 H16 N4 O S2 |
| Smiles: | Cc1cc(cs1)c1nnc(n1C)SCC(Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0704 |
| logD: | 3.0704 |
| logSw: | -3.4206 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.218 |
| InChI Key: | BDMNHFHVEHACSM-UHFFFAOYSA-N |