N-[4-(cyanomethyl)phenyl]-2-(3-methyl-4-nitrophenoxy)acetamide
Chemical Structure Depiction of
N-[4-(cyanomethyl)phenyl]-2-(3-methyl-4-nitrophenoxy)acetamide
N-[4-(cyanomethyl)phenyl]-2-(3-methyl-4-nitrophenoxy)acetamide
Compound characteristics
| Compound ID: | 8013-2529 |
| Compound Name: | N-[4-(cyanomethyl)phenyl]-2-(3-methyl-4-nitrophenoxy)acetamide |
| Molecular Weight: | 325.32 |
| Molecular Formula: | C17 H15 N3 O4 |
| Smiles: | Cc1cc(ccc1[N+]([O-])=O)OCC(Nc1ccc(CC#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9565 |
| logD: | 2.9565 |
| logSw: | -3.4811 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.188 |
| InChI Key: | BJYVUJUKJIDKCX-UHFFFAOYSA-N |