methyl 4-{[4-(methoxycarbonyl)phenyl]methylidene}-2-methyl-5-oxo-1-(2-phenylethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-{[4-(methoxycarbonyl)phenyl]methylidene}-2-methyl-5-oxo-1-(2-phenylethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-{[4-(methoxycarbonyl)phenyl]methylidene}-2-methyl-5-oxo-1-(2-phenylethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 5567-0121 |
| Compound Name: | methyl 4-{[4-(methoxycarbonyl)phenyl]methylidene}-2-methyl-5-oxo-1-(2-phenylethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 405.45 |
| Molecular Formula: | C24 H23 N O5 |
| Smiles: | CC1=C(/C(=C/c2ccc(cc2)C(=O)OC)C(N1CCc1ccccc1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.0356 |
| logD: | 4.0356 |
| logSw: | -4.2756 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.263 |
| InChI Key: | IGXPCQIUYWTDAU-UHFFFAOYSA-N |