ethyl 6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-(2-nitrophenyl)-4H-pyran-3-carboxylate
Chemical Structure Depiction of
ethyl 6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-(2-nitrophenyl)-4H-pyran-3-carboxylate
ethyl 6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-(2-nitrophenyl)-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | 8008-1690 |
| Compound Name: | ethyl 6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-(2-nitrophenyl)-4H-pyran-3-carboxylate |
| Molecular Weight: | 401.37 |
| Molecular Formula: | C19 H19 N3 O7 |
| Smiles: | CCOC(CC1=C(C(C(C#N)=C(N)O1)c1ccccc1[N+]([O-])=O)C(=O)OCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0532 |
| logD: | 2.0532 |
| logSw: | -2.5267 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 120.88 |
| InChI Key: | FYKOQSNAXGEQBX-MRXNPFEDSA-N |