4-{[(4-acetamidophenyl)imino]methyl}phenyl 3-nitrobenzoate
Chemical Structure Depiction of
4-{[(4-acetamidophenyl)imino]methyl}phenyl 3-nitrobenzoate
4-{[(4-acetamidophenyl)imino]methyl}phenyl 3-nitrobenzoate
Compound characteristics
| Compound ID: | 8003-9040 |
| Compound Name: | 4-{[(4-acetamidophenyl)imino]methyl}phenyl 3-nitrobenzoate |
| Molecular Weight: | 403.39 |
| Molecular Formula: | C22 H17 N3 O5 |
| Smiles: | CC(Nc1ccc(cc1)/N=C/c1ccc(cc1)OC(c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3062 |
| logD: | 3.3051 |
| logSw: | -3.8372 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.387 |
| InChI Key: | MGDNTUXMEWCXCZ-UHFFFAOYSA-N |