N-[(2-methylphenyl)methyl]-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Chemical Structure Depiction of
N-[(2-methylphenyl)methyl]-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
N-[(2-methylphenyl)methyl]-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Compound characteristics
| Compound ID: | M031-0230 |
| Compound Name: | N-[(2-methylphenyl)methyl]-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide |
| Molecular Weight: | 306.37 |
| Molecular Formula: | C18 H18 N4 O |
| Smiles: | Cc1ccccc1CNC(c1ccc(Cn2cncn2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4196 |
| logD: | 2.4194 |
| logSw: | -2.4737 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.629 |
| InChI Key: | SZRYVHUHRXKMCX-UHFFFAOYSA-N |