N-{2-[(1-benzyl-3-bromo-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-(2-methylphenyl)acetamide
Chemical Structure Depiction of
N-{2-[(1-benzyl-3-bromo-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-(2-methylphenyl)acetamide
N-{2-[(1-benzyl-3-bromo-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-(2-methylphenyl)acetamide
Compound characteristics
| Compound ID: | L150-0326 |
| Compound Name: | N-{2-[(1-benzyl-3-bromo-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-(2-methylphenyl)acetamide |
| Molecular Weight: | 493.42 |
| Molecular Formula: | C24 H21 Br N4 O S |
| Smiles: | Cc1ccccc1CC(Nc1ccccc1Sc1nc(nn1Cc1ccccc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.7756 |
| logD: | 5.7756 |
| logSw: | -5.4674 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.215 |
| InChI Key: | DOZXRTTYXTVIPX-UHFFFAOYSA-N |