2-chloro-N-{4-[5-(4-methylphenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}acetamide
Chemical Structure Depiction of
2-chloro-N-{4-[5-(4-methylphenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}acetamide
2-chloro-N-{4-[5-(4-methylphenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}acetamide
Compound characteristics
| Compound ID: | V008-0607 |
| Compound Name: | 2-chloro-N-{4-[5-(4-methylphenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}acetamide |
| Molecular Weight: | 398.89 |
| Molecular Formula: | C21 H23 Cl N4 O2 |
| Smiles: | CC(C)COc1nc(c2ccc(C)cc2)n(c2ccc(cc2)NC(C[Cl])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.265 |
| logD: | 5.2649 |
| logSw: | -5.3215 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.339 |
| InChI Key: | CHZQBWZVMCCGSB-UHFFFAOYSA-N |