methyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-(3-methoxyphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-(3-methoxyphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-(3-methoxyphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-2747 |
| Compound Name: | methyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-(3-methoxyphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 393.39 |
| Molecular Formula: | C22 H19 N O6 |
| Smiles: | CC1=C(/C(=C/c2ccc3c(c2)OCO3)C(N1c1cccc(c1)OC)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.4307 |
| logD: | 3.4307 |
| logSw: | -3.6246 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.158 |
| InChI Key: | UGTVCBMQMACFEX-UHFFFAOYSA-N |