methyl 4-[(3-chlorophenyl)methylidene]-1,2-dimethyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(3-chlorophenyl)methylidene]-1,2-dimethyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-[(3-chlorophenyl)methylidene]-1,2-dimethyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 8008-4454 |
| Compound Name: | methyl 4-[(3-chlorophenyl)methylidene]-1,2-dimethyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 291.73 |
| Molecular Formula: | C15 H14 Cl N O3 |
| Smiles: | CC1=C(/C(=C/c2cccc(c2)[Cl])C(N1C)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.5447 |
| logD: | 2.5447 |
| logSw: | -3.1602 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.148 |
| InChI Key: | NCLMMOHHVHFTQW-UHFFFAOYSA-N |