N-(3-chloro-4-methoxyphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
N-(3-chloro-4-methoxyphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Compound characteristics
| Compound ID: | M031-0159 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide |
| Molecular Weight: | 342.78 |
| Molecular Formula: | C17 H15 Cl N4 O2 |
| Smiles: | COc1ccc(cc1[Cl])NC(c1ccc(Cn2cncn2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3764 |
| logD: | 2.363 |
| logSw: | -3.4588 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.937 |
| InChI Key: | DDBGBTSDHAORSM-UHFFFAOYSA-N |