N-{2-[(1-benzyl-3-chloro-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-ethoxybenzamide
Chemical Structure Depiction of
N-{2-[(1-benzyl-3-chloro-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-ethoxybenzamide
N-{2-[(1-benzyl-3-chloro-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-ethoxybenzamide
Compound characteristics
| Compound ID: | C301-9421 |
| Compound Name: | N-{2-[(1-benzyl-3-chloro-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-ethoxybenzamide |
| Molecular Weight: | 464.97 |
| Molecular Formula: | C24 H21 Cl N4 O2 S |
| Smiles: | CCOc1ccccc1C(Nc1ccccc1Sc1nc(nn1Cc1ccccc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3338 |
| logD: | 5.3338 |
| logSw: | -5.7996 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.672 |
| InChI Key: | ZDAZAEPVBLLNKY-UHFFFAOYSA-N |