N-(4-cyanophenyl)-4,5-dimethoxy-2-nitrobenzamide
Chemical Structure Depiction of
N-(4-cyanophenyl)-4,5-dimethoxy-2-nitrobenzamide
N-(4-cyanophenyl)-4,5-dimethoxy-2-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-0522 |
| Compound Name: | N-(4-cyanophenyl)-4,5-dimethoxy-2-nitrobenzamide |
| Molecular Weight: | 327.29 |
| Molecular Formula: | C16 H13 N3 O5 |
| Smiles: | COc1cc(C(Nc2ccc(C#N)cc2)=O)c(cc1OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.196 |
| logD: | 1.9116 |
| logSw: | -3.1664 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.727 |
| InChI Key: | GLENJTKAMUBSHK-UHFFFAOYSA-N |