methyl 1-(3-methoxypropyl)-2-methyl-4-{[4-(methylsulfanyl)phenyl]methylidene}-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 1-(3-methoxypropyl)-2-methyl-4-{[4-(methylsulfanyl)phenyl]methylidene}-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 1-(3-methoxypropyl)-2-methyl-4-{[4-(methylsulfanyl)phenyl]methylidene}-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-2868 |
| Compound Name: | methyl 1-(3-methoxypropyl)-2-methyl-4-{[4-(methylsulfanyl)phenyl]methylidene}-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 361.46 |
| Molecular Formula: | C19 H23 N O4 S |
| Smiles: | CC1=C(/C(=C/c2ccc(cc2)SC)C(N1CCCOC)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.1572 |
| logD: | 3.1572 |
| logSw: | -3.2157 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.703 |
| InChI Key: | JXZOKRTUNKMZIL-UHFFFAOYSA-N |