methyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-[2-(cyclohex-1-en-1-yl)ethyl]-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-[2-(cyclohex-1-en-1-yl)ethyl]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 5618-4176 |
| Compound Name: | methyl 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 395.45 |
| Molecular Formula: | C23 H25 N O5 |
| Smiles: | CC1=C(/C(=C/c2ccc3c(c2)OCO3)C(N1CCC1CCCCC=1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.0976 |
| logD: | 4.0976 |
| logSw: | -4.2518 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.396 |
| InChI Key: | JFUDGYPYMPAAHQ-UHFFFAOYSA-N |