ethyl 5-cyano-2-methyl-4-(3-nitrophenyl)-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
Chemical Structure Depiction of
ethyl 5-cyano-2-methyl-4-(3-nitrophenyl)-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
ethyl 5-cyano-2-methyl-4-(3-nitrophenyl)-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | 8017-7980 |
| Compound Name: | ethyl 5-cyano-2-methyl-4-(3-nitrophenyl)-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate |
| Molecular Weight: | 379.37 |
| Molecular Formula: | C20 H17 N3 O5 |
| Smiles: | CCOC(C1C(C(C#N)=C(n2cccc2)OC=1C)c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6068 |
| logD: | 3.6068 |
| logSw: | -3.7941 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 83.61 |
| InChI Key: | ADDQMWWSSFSDPR-GOSISDBHSA-N |