N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)-3-methoxybenzamide
Chemical Structure Depiction of
N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)-3-methoxybenzamide
N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)-3-methoxybenzamide
Compound characteristics
| Compound ID: | L150-0279 |
| Compound Name: | N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)-3-methoxybenzamide |
| Molecular Weight: | 464.97 |
| Molecular Formula: | C24 H21 Cl N4 O2 S |
| Smiles: | COc1cccc(c1)C(Nc1ccccc1Sc1nc(nn1CCc1ccccc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3462 |
| logD: | 5.3462 |
| logSw: | -5.8864 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.984 |
| InChI Key: | RUUARQQEJULHEE-UHFFFAOYSA-N |