2-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-N-(4-ethylphenyl)acetamide
Chemical Structure Depiction of
2-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-N-(4-ethylphenyl)acetamide
2-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-N-(4-ethylphenyl)acetamide
Compound characteristics
| Compound ID: | 4360-0095F |
| Compound Name: | 2-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-N-(4-ethylphenyl)acetamide |
| Molecular Weight: | 352.46 |
| Molecular Formula: | C19 H20 N4 O S |
| Smiles: | CCc1ccc(cc1)NC(Cn1cnc(n1)SCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.26 |
| logD: | 4.26 |
| logSw: | -4.0871 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.926 |
| InChI Key: | MDTAHNLYXKYJEH-UHFFFAOYSA-N |