N-(5-chloro-2-methylphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Chemical Structure Depiction of
N-(5-chloro-2-methylphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
N-(5-chloro-2-methylphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Compound characteristics
| Compound ID: | M031-0036 |
| Compound Name: | N-(5-chloro-2-methylphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide |
| Molecular Weight: | 326.78 |
| Molecular Formula: | C17 H15 Cl N4 O |
| Smiles: | Cc1ccc(cc1NC(c1ccc(Cn2cncn2)cc1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.5211 |
| logD: | 2.5101 |
| logSw: | -3.4768 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.609 |
| InChI Key: | JVGBGCMSPOWKOO-UHFFFAOYSA-N |