N-(3,5-dimethoxyphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Chemical Structure Depiction of
N-(3,5-dimethoxyphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
N-(3,5-dimethoxyphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Compound characteristics
| Compound ID: | M031-0045 |
| Compound Name: | N-(3,5-dimethoxyphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide |
| Molecular Weight: | 338.36 |
| Molecular Formula: | C18 H18 N4 O3 |
| Smiles: | COc1cc(cc(c1)OC)NC(c1ccc(Cn2cncn2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0048 |
| logD: | 1.9972 |
| logSw: | -2.6669 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.394 |
| InChI Key: | NJZQKIOYTBUQPN-UHFFFAOYSA-N |