N-(3-chloro-4-methylphenyl)-3-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-3-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
N-(3-chloro-4-methylphenyl)-3-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Compound characteristics
| Compound ID: | M032-0090 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-3-[(1H-1,2,4-triazol-1-yl)methyl]benzamide |
| Molecular Weight: | 326.78 |
| Molecular Formula: | C17 H15 Cl N4 O |
| Smiles: | Cc1ccc(cc1[Cl])NC(c1cccc(Cn2cncn2)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2703 |
| logD: | 3.2477 |
| logSw: | -3.6065 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.306 |
| InChI Key: | JEQKRTOAHWSUNW-UHFFFAOYSA-N |