methyl 4-[(5-bromo-2-methoxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(5-bromo-2-methoxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-[(5-bromo-2-methoxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 8008-4586 |
| Compound Name: | methyl 4-[(5-bromo-2-methoxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 352.18 |
| Molecular Formula: | C15 H14 Br N O4 |
| Smiles: | CC1=C(/C(=C/c2cc(ccc2OC)[Br])C(N1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.8409 |
| logD: | 2.7209 |
| logSw: | -3.3703 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.666 |
| InChI Key: | GKVQORFXRPZOOG-UHFFFAOYSA-N |