N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)-2,6-difluorobenzamide
Chemical Structure Depiction of
N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)-2,6-difluorobenzamide
N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)-2,6-difluorobenzamide
Compound characteristics
| Compound ID: | L150-0268 |
| Compound Name: | N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)-2,6-difluorobenzamide |
| Molecular Weight: | 470.93 |
| Molecular Formula: | C23 H17 Cl F2 N4 O S |
| Smiles: | C(Cn1c(nc(n1)[Cl])Sc1ccccc1NC(c1c(cccc1F)F)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5784 |
| logD: | 5.5782 |
| logSw: | -6.1959 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.441 |
| InChI Key: | BPVHRTNRYIBSBB-UHFFFAOYSA-N |