ethyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-(4-methoxyphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-(4-methoxyphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
ethyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-(4-methoxyphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
Compound ID: | 4031-2069 |
Compound Name: | ethyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-(4-methoxyphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
Molecular Weight: | 407.42 |
Molecular Formula: | C23 H21 N O6 |
Smiles: | CCOC(C1/C(=C/c2ccc3c(c2)OCO3)C(N(C=1C)c1ccc(cc1)OC)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.8215 |
logD: | 3.8215 |
logSw: | -4.0436 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 60.738 |
InChI Key: | ILUWZMULZHVXCJ-UHFFFAOYSA-N |