N-(5-chloro-2,4-dimethoxyphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
N-(5-chloro-2,4-dimethoxyphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Compound characteristics
| Compound ID: | M031-0034 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide |
| Molecular Weight: | 372.81 |
| Molecular Formula: | C18 H17 Cl N4 O3 |
| Smiles: | COc1cc(c(cc1NC(c1ccc(Cn2cncn2)cc1)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 2.3628 |
| logD: | 2.0911 |
| logSw: | -3.4858 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.869 |
| InChI Key: | SRKINVWWZPLZNK-UHFFFAOYSA-N |