ethyl 2-cyano-3-[4-(4-nitrobenzamido)phenyl]-3-oxopropanoate
Chemical Structure Depiction of
ethyl 2-cyano-3-[4-(4-nitrobenzamido)phenyl]-3-oxopropanoate
ethyl 2-cyano-3-[4-(4-nitrobenzamido)phenyl]-3-oxopropanoate
Compound characteristics
| Compound ID: | 8006-2897 |
| Compound Name: | ethyl 2-cyano-3-[4-(4-nitrobenzamido)phenyl]-3-oxopropanoate |
| Molecular Weight: | 381.34 |
| Molecular Formula: | C19 H15 N3 O6 |
| Smiles: | CCOC(C(C#N)C(c1ccc(cc1)NC(c1ccc(cc1)[N+]([O-])=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4525 |
| logD: | -0.04 |
| logSw: | -2.8528 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 108.26 |
| InChI Key: | XFEBWASWHYOUFZ-INIZCTEOSA-N |