N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)-4-fluorobenzamide
Chemical Structure Depiction of
N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)-4-fluorobenzamide
N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)-4-fluorobenzamide
Compound characteristics
| Compound ID: | L150-0280 |
| Compound Name: | N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)-4-fluorobenzamide |
| Molecular Weight: | 452.94 |
| Molecular Formula: | C23 H18 Cl F N4 O S |
| Smiles: | C(Cn1c(nc(n1)[Cl])Sc1ccccc1NC(c1ccc(cc1)F)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3131 |
| logD: | 5.3131 |
| logSw: | -5.9179 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.441 |
| InChI Key: | LYLOHESQDPNXKH-UHFFFAOYSA-N |