methyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-methyl-5-oxo-1-[4-(propan-2-yl)phenyl]-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-methyl-5-oxo-1-[4-(propan-2-yl)phenyl]-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-methyl-5-oxo-1-[4-(propan-2-yl)phenyl]-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-2751 |
| Compound Name: | methyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-methyl-5-oxo-1-[4-(propan-2-yl)phenyl]-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 405.45 |
| Molecular Formula: | C24 H23 N O5 |
| Smiles: | CC(C)c1ccc(cc1)N1C(C)=C(/C(=C/c2ccc3c(c2)OCO3)C1=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.605 |
| logD: | 4.605 |
| logSw: | -4.5067 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.614 |
| InChI Key: | HSFOMELRDXXIRB-UHFFFAOYSA-N |