methyl 5-[(2,5-dimethoxyphenyl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 5-[(2,5-dimethoxyphenyl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 5-[(2,5-dimethoxyphenyl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4191-4045 |
| Compound Name: | methyl 5-[(2,5-dimethoxyphenyl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 303.31 |
| Molecular Formula: | C16 H17 N O5 |
| Smiles: | CC1=C(C(/C(=C\c2cc(ccc2OC)OC)N1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.5499 |
| logD: | 2.5253 |
| logSw: | -3.0527 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.659 |
| InChI Key: | HNVWIXDWBCNJMR-UHFFFAOYSA-N |