methyl 4-[(3-chlorophenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(3-chlorophenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-[(3-chlorophenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 8008-6021 |
| Compound Name: | methyl 4-[(3-chlorophenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 333.81 |
| Molecular Formula: | C18 H20 Cl N O3 |
| Smiles: | CC(C)CN1C(C)=C(/C(=C/c2cccc(c2)[Cl])C1=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.0239 |
| logD: | 4.0239 |
| logSw: | -4.4367 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.382 |
| InChI Key: | URFTYQCGYIEEIK-UHFFFAOYSA-N |