2-[5-(benzylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]-N-(2-ethylphenyl)acetamide
Chemical Structure Depiction of
2-[5-(benzylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]-N-(2-ethylphenyl)acetamide
2-[5-(benzylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]-N-(2-ethylphenyl)acetamide
Compound characteristics
| Compound ID: | F166-0734 |
| Compound Name: | 2-[5-(benzylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]-N-(2-ethylphenyl)acetamide |
| Molecular Weight: | 428.56 |
| Molecular Formula: | C25 H24 N4 O S |
| Smiles: | CCc1ccccc1NC(Cc1nnc(n1c1ccccc1)SCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4282 |
| logD: | 4.4282 |
| logSw: | -4.259 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.14 |
| InChI Key: | KZDMOONSAGRHFG-UHFFFAOYSA-N |