2-({4-benzyl-5-[(4-bromophenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-dichlorophenyl)acetamide
Chemical Structure Depiction of
2-({4-benzyl-5-[(4-bromophenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-dichlorophenyl)acetamide
2-({4-benzyl-5-[(4-bromophenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-dichlorophenyl)acetamide
Compound characteristics
| Compound ID: | 8014-4196 |
| Compound Name: | 2-({4-benzyl-5-[(4-bromophenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-dichlorophenyl)acetamide |
| Molecular Weight: | 578.31 |
| Molecular Formula: | C24 H19 Br Cl2 N4 O2 S |
| Smiles: | C(c1ccccc1)n1c(COc2ccc(cc2)[Br])nnc1SCC(Nc1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.7199 |
| logD: | 6.7117 |
| logSw: | -6.5224 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.594 |
| InChI Key: | KHKOZGFDBXNQHI-UHFFFAOYSA-N |