N-(4-acetylphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Chemical Structure Depiction of
N-(4-acetylphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
N-(4-acetylphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Compound characteristics
| Compound ID: | M031-0005 |
| Compound Name: | N-(4-acetylphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide |
| Molecular Weight: | 320.35 |
| Molecular Formula: | C18 H16 N4 O2 |
| Smiles: | CC(c1ccc(cc1)NC(c1ccc(Cn2cncn2)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4078 |
| logD: | 1.3974 |
| logSw: | -2.0082 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.133 |
| InChI Key: | WMTSMLLWMGKEAG-UHFFFAOYSA-N |