N-[2-({3-chloro-1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]-3-methylbenzamide
Chemical Structure Depiction of
N-[2-({3-chloro-1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]-3-methylbenzamide
N-[2-({3-chloro-1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]-3-methylbenzamide
Compound characteristics
| Compound ID: | F938-0245 |
| Compound Name: | N-[2-({3-chloro-1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]-3-methylbenzamide |
| Molecular Weight: | 469.39 |
| Molecular Formula: | C23 H18 Cl2 N4 O S |
| Smiles: | Cc1cccc(c1)C(Nc1ccccc1Sc1nc(nn1Cc1ccc(cc1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.0207 |
| logD: | 6.0207 |
| logSw: | -6.1049 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.462 |
| InChI Key: | XZOHCLVHKYRNEH-UHFFFAOYSA-N |