methyl 4-[(3-bromophenyl)methylidene]-1-(2-methoxyethyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(3-bromophenyl)methylidene]-1-(2-methoxyethyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-[(3-bromophenyl)methylidene]-1-(2-methoxyethyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-0076 |
| Compound Name: | methyl 4-[(3-bromophenyl)methylidene]-1-(2-methoxyethyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 380.24 |
| Molecular Formula: | C17 H18 Br N O4 |
| Smiles: | CC1=C(/C(=C/c2cccc(c2)[Br])C(N1CCOC)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.8469 |
| logD: | 2.8469 |
| logSw: | -3.0353 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.703 |
| InChI Key: | NIMWQJATXLPZDJ-UHFFFAOYSA-N |