methyl 4-{[4-(methoxycarbonyl)phenyl]methylidene}-1-(3-methoxypropyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-{[4-(methoxycarbonyl)phenyl]methylidene}-1-(3-methoxypropyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-{[4-(methoxycarbonyl)phenyl]methylidene}-1-(3-methoxypropyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 5567-0115 |
| Compound Name: | methyl 4-{[4-(methoxycarbonyl)phenyl]methylidene}-1-(3-methoxypropyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 373.4 |
| Molecular Formula: | C20 H23 N O6 |
| Smiles: | CC1=C(/C(=C/c2ccc(cc2)C(=O)OC)C(N1CCCOC)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.5287 |
| logD: | 2.5287 |
| logSw: | -2.4441 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.877 |
| InChI Key: | DSKKOVDMSUZWBN-UHFFFAOYSA-N |