N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)benzamide
N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)benzamide
Compound characteristics
| Compound ID: | L150-0099 |
| Compound Name: | N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)benzamide |
| Molecular Weight: | 434.95 |
| Molecular Formula: | C23 H19 Cl N4 O S |
| Smiles: | C(Cn1c(nc(n1)[Cl])Sc1ccccc1NC(c1ccccc1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.179 |
| logD: | 5.179 |
| logSw: | -5.6751 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.441 |
| InChI Key: | KKRYQYUBSOBYMS-UHFFFAOYSA-N |