N-(2-methylphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Chemical Structure Depiction of
N-(2-methylphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
N-(2-methylphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Compound characteristics
| Compound ID: | M031-0087 |
| Compound Name: | N-(2-methylphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide |
| Molecular Weight: | 292.34 |
| Molecular Formula: | C17 H16 N4 O |
| Smiles: | Cc1ccccc1NC(c1ccc(Cn2cncn2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8588 |
| logD: | 1.8587 |
| logSw: | -2.2257 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.609 |
| InChI Key: | POKMTCYOSOJASI-UHFFFAOYSA-N |