N-[4-(cyanomethyl)phenyl]-2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}benzamide
Chemical Structure Depiction of
N-[4-(cyanomethyl)phenyl]-2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}benzamide
N-[4-(cyanomethyl)phenyl]-2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}benzamide
Compound characteristics
| Compound ID: | 8018-0322 |
| Compound Name: | N-[4-(cyanomethyl)phenyl]-2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}benzamide |
| Molecular Weight: | 398.5 |
| Molecular Formula: | C26 H26 N2 O2 |
| Smiles: | CC(C)c1ccc(C)cc1OCc1ccccc1C(Nc1ccc(CC#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6682 |
| logD: | 5.6676 |
| logSw: | -5.4116 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.136 |
| InChI Key: | VEMSYPZPKDPLHL-UHFFFAOYSA-N |