2-{[5-(2-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-{[5-(2-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide
2-{[5-(2-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide
Compound characteristics
| Compound ID: | C592-3815 |
| Compound Name: | 2-{[5-(2-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide |
| Molecular Weight: | 493.42 |
| Molecular Formula: | C24 H21 Br N4 O S |
| Smiles: | Cc1cccc(C)c1NC(CSc1nnc(c2ccccc2[Br])n1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9352 |
| logD: | 4.9352 |
| logSw: | -4.6055 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.466 |
| InChI Key: | WVWNJPVBJDMGPT-UHFFFAOYSA-N |