N-(1-benzyl-1H-1,2,4-triazol-3-yl)-2,4-dichlorobenzamide
Chemical Structure Depiction of
N-(1-benzyl-1H-1,2,4-triazol-3-yl)-2,4-dichlorobenzamide
N-(1-benzyl-1H-1,2,4-triazol-3-yl)-2,4-dichlorobenzamide
Compound characteristics
| Compound ID: | Y502-1741 |
| Compound Name: | N-(1-benzyl-1H-1,2,4-triazol-3-yl)-2,4-dichlorobenzamide |
| Molecular Weight: | 347.2 |
| Molecular Formula: | C16 H12 Cl2 N4 O |
| Smiles: | C(c1ccccc1)n1cnc(NC(c2ccc(cc2[Cl])[Cl])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.8787 |
| logD: | 2.4678 |
| logSw: | -4.4875 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.551 |
| InChI Key: | VXBJFZOMMCZVMT-UHFFFAOYSA-N |