3-[3-benzoyl-4-hydroxy-2-(2-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
Chemical Structure Depiction of
3-[3-benzoyl-4-hydroxy-2-(2-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
3-[3-benzoyl-4-hydroxy-2-(2-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
Compound characteristics
| Compound ID: | 4393-0304 |
| Compound Name: | 3-[3-benzoyl-4-hydroxy-2-(2-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid |
| Molecular Weight: | 396.35 |
| Molecular Formula: | C20 H16 N2 O7 |
| Smiles: | C(CN1C(C(=C(C1=O)O)C(c1ccccc1)=O)c1ccccc1[N+]([O-])=O)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3968 |
| logD: | -1.2989 |
| logSw: | -2.022 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.541 |
| InChI Key: | QJNAJPMPXOWBGF-QGZVFWFLSA-N |