N-(4-ethylphenyl)-2-{[4-(2-phenylethyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-ethylphenyl)-2-{[4-(2-phenylethyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(4-ethylphenyl)-2-{[4-(2-phenylethyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 5236-0417 |
| Compound Name: | N-(4-ethylphenyl)-2-{[4-(2-phenylethyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 448.61 |
| Molecular Formula: | C24 H24 N4 O S2 |
| Smiles: | CCc1ccc(cc1)NC(CSc1nnc(c2cccs2)n1CCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.794 |
| logD: | 5.794 |
| logSw: | -5.4531 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.115 |
| InChI Key: | CQBLLBVQBQKBTO-UHFFFAOYSA-N |