N-[2-(4-chlorophenyl)ethyl]-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
N-[2-(4-chlorophenyl)ethyl]-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Compound characteristics
| Compound ID: | M031-0037 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide |
| Molecular Weight: | 340.81 |
| Molecular Formula: | C18 H17 Cl N4 O |
| Smiles: | C(CNC(c1ccc(Cn2cncn2)cc1)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.0599 |
| logD: | 2.0599 |
| logSw: | -3.0854 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.47 |
| InChI Key: | PNGNWGYBDDKRNN-UHFFFAOYSA-N |