methyl 1-[2-(4-methoxyphenyl)ethyl]-2-methyl-5-oxo-4-[(thiophen-2-yl)methylidene]-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 1-[2-(4-methoxyphenyl)ethyl]-2-methyl-5-oxo-4-[(thiophen-2-yl)methylidene]-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 1-[2-(4-methoxyphenyl)ethyl]-2-methyl-5-oxo-4-[(thiophen-2-yl)methylidene]-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 5641-0599 |
| Compound Name: | methyl 1-[2-(4-methoxyphenyl)ethyl]-2-methyl-5-oxo-4-[(thiophen-2-yl)methylidene]-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 383.46 |
| Molecular Formula: | C21 H21 N O4 S |
| Smiles: | CC1=C(/C(=C/c2cccs2)C(N1CCc1ccc(cc1)OC)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.4724 |
| logD: | 3.4724 |
| logSw: | -3.647 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.651 |
| InChI Key: | PUURBTDLVXVWDZ-UHFFFAOYSA-N |