N-[2-({3-chloro-1-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]-2,6-dimethoxybenzamide
Chemical Structure Depiction of
N-[2-({3-chloro-1-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]-2,6-dimethoxybenzamide
N-[2-({3-chloro-1-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]-2,6-dimethoxybenzamide
Compound characteristics
| Compound ID: | F938-0216 |
| Compound Name: | N-[2-({3-chloro-1-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]-2,6-dimethoxybenzamide |
| Molecular Weight: | 495 |
| Molecular Formula: | C25 H23 Cl N4 O3 S |
| Smiles: | Cc1ccc(Cn2c(nc(n2)[Cl])Sc2ccccc2NC(c2c(cccc2OC)OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.001 |
| logD: | 5.0002 |
| logSw: | -5.2261 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.723 |
| InChI Key: | CSVHDVZPVLIPMO-UHFFFAOYSA-N |