methyl 4-[(5-bromo-2-methoxyphenyl)methylidene]-1-(3-methoxypropyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(5-bromo-2-methoxyphenyl)methylidene]-1-(3-methoxypropyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-[(5-bromo-2-methoxyphenyl)methylidene]-1-(3-methoxypropyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4257-4218 |
| Compound Name: | methyl 4-[(5-bromo-2-methoxyphenyl)methylidene]-1-(3-methoxypropyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 424.29 |
| Molecular Formula: | C19 H22 Br N O5 |
| Smiles: | CC1=C(/C(=C/c2cc(ccc2OC)[Br])C(N1CCCOC)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.2324 |
| logD: | 3.2324 |
| logSw: | -3.2338 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.333 |
| InChI Key: | SNICCYUUIIAYMR-UHFFFAOYSA-N |