3-[3-acetyl-4-hydroxy-2-(2-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
Chemical Structure Depiction of
3-[3-acetyl-4-hydroxy-2-(2-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
3-[3-acetyl-4-hydroxy-2-(2-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
Compound characteristics
Compound ID: | 4393-0328 |
Compound Name: | 3-[3-acetyl-4-hydroxy-2-(2-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid |
Molecular Weight: | 334.28 |
Molecular Formula: | C15 H14 N2 O7 |
Smiles: | CC(C1C(c2ccccc2[N+]([O-])=O)N(CCC(O)=O)C(C=1O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | -0.1794 |
logD: | -2.8751 |
logSw: | -1.6818 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 106.901 |
InChI Key: | CQDKDOAWROUQMK-CYBMUJFWSA-N |