2-[(4-methylphenyl)sulfanyl]-N-(4H-1,2,4-triazol-3-yl)acetamide
Chemical Structure Depiction of
2-[(4-methylphenyl)sulfanyl]-N-(4H-1,2,4-triazol-3-yl)acetamide
2-[(4-methylphenyl)sulfanyl]-N-(4H-1,2,4-triazol-3-yl)acetamide
Compound characteristics
| Compound ID: | 7882-3257 |
| Compound Name: | 2-[(4-methylphenyl)sulfanyl]-N-(4H-1,2,4-triazol-3-yl)acetamide |
| Molecular Weight: | 248.3 |
| Molecular Formula: | C11 H12 N4 O S |
| Smiles: | Cc1ccc(cc1)SCC(Nc1nnc[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0436 |
| logD: | 1.0291 |
| logSw: | -2.3025 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.954 |
| InChI Key: | BCLVVABXGZBQJU-UHFFFAOYSA-N |