methyl 4-[(2,3-dimethoxyphenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(2,3-dimethoxyphenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-[(2,3-dimethoxyphenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-0402 |
| Compound Name: | methyl 4-[(2,3-dimethoxyphenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 359.42 |
| Molecular Formula: | C20 H25 N O5 |
| Smiles: | CC(C)CN1C(C)=C(/C(=C/c2cccc(c2OC)OC)C1=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.2357 |
| logD: | 3.2357 |
| logSw: | -3.3843 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.729 |
| InChI Key: | WCQOCFIOUUOABI-UHFFFAOYSA-N |