4-chloro-N-(2-cyano-4,5-diethoxyphenyl)-3-nitrobenzamide
Chemical Structure Depiction of
4-chloro-N-(2-cyano-4,5-diethoxyphenyl)-3-nitrobenzamide
4-chloro-N-(2-cyano-4,5-diethoxyphenyl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | 8015-1136 |
| Compound Name: | 4-chloro-N-(2-cyano-4,5-diethoxyphenyl)-3-nitrobenzamide |
| Molecular Weight: | 389.79 |
| Molecular Formula: | C18 H16 Cl N3 O5 |
| Smiles: | CCOc1cc(C#N)c(cc1OCC)NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8197 |
| logD: | 0.5127 |
| logSw: | -3.7291 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.189 |
| InChI Key: | AZFHRHQTCMSMRN-UHFFFAOYSA-N |