3-[3-benzoyl-2-(2,5-dimethoxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
Chemical Structure Depiction of
3-[3-benzoyl-2-(2,5-dimethoxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
3-[3-benzoyl-2-(2,5-dimethoxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
Compound characteristics
| Compound ID: | 4393-0297 |
| Compound Name: | 3-[3-benzoyl-2-(2,5-dimethoxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid |
| Molecular Weight: | 411.41 |
| Molecular Formula: | C22 H21 N O7 |
| Smiles: | COc1ccc(c(c1)C1C(=C(C(N1CCC(O)=O)=O)O)C(c1ccccc1)=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7587 |
| logD: | -0.937 |
| logSw: | -2.395 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.635 |
| InChI Key: | NXAJDDWHVXLVGC-LJQANCHMSA-N |