N-[2-({3-chloro-1-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]-3-fluorobenzamide
Chemical Structure Depiction of
N-[2-({3-chloro-1-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]-3-fluorobenzamide
N-[2-({3-chloro-1-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]-3-fluorobenzamide
Compound characteristics
| Compound ID: | F938-0197 |
| Compound Name: | N-[2-({3-chloro-1-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]-3-fluorobenzamide |
| Molecular Weight: | 452.94 |
| Molecular Formula: | C23 H18 Cl F N4 O S |
| Smiles: | Cc1ccc(Cn2c(nc(n2)[Cl])Sc2ccccc2NC(c2cccc(c2)F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.6011 |
| logD: | 5.601 |
| logSw: | -5.9289 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.462 |
| InChI Key: | YEOMWKVIVZNKLP-UHFFFAOYSA-N |