methyl 4-[(2,4-dimethoxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(2,4-dimethoxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-[(2,4-dimethoxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-0069 |
| Compound Name: | methyl 4-[(2,4-dimethoxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 303.31 |
| Molecular Formula: | C16 H17 N O5 |
| Smiles: | CC1=C(/C(=C/c2ccc(cc2OC)OC)C(N1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.056 |
| logD: | 1.9361 |
| logSw: | -2.8747 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.21 |
| InChI Key: | HJSVRSJPOSDYBT-UHFFFAOYSA-N |