ethyl 6-amino-5-cyano-2-methyl-4-(2-nitrophenyl)-4H-pyran-3-carboxylate
Chemical Structure Depiction of
ethyl 6-amino-5-cyano-2-methyl-4-(2-nitrophenyl)-4H-pyran-3-carboxylate
ethyl 6-amino-5-cyano-2-methyl-4-(2-nitrophenyl)-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | 8003-1131 |
| Compound Name: | ethyl 6-amino-5-cyano-2-methyl-4-(2-nitrophenyl)-4H-pyran-3-carboxylate |
| Molecular Weight: | 329.31 |
| Molecular Formula: | C16 H15 N3 O5 |
| Smiles: | CCOC(C1C(C(C#N)=C(N)OC=1C)c1ccccc1[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0178 |
| logD: | 2.0178 |
| logSw: | -2.3727 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.527 |
| InChI Key: | IGOZQGBOETZFPT-CQSZACIVSA-N |