ethyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrrole-3-carboxylate
ethyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-2046 |
| Compound Name: | ethyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 377.4 |
| Molecular Formula: | C22 H19 N O5 |
| Smiles: | CCOC(C1/C(=C/c2ccc3c(c2)OCO3)C(N(C=1C)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7176 |
| logD: | 3.7176 |
| logSw: | -3.8948 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.194 |
| InChI Key: | PWPGVEBHZGRANF-UHFFFAOYSA-N |