methyl 4-[(5-bromo-2-methoxyphenyl)methylidene]-1-(4-fluorophenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(5-bromo-2-methoxyphenyl)methylidene]-1-(4-fluorophenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-[(5-bromo-2-methoxyphenyl)methylidene]-1-(4-fluorophenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4207-0115 |
| Compound Name: | methyl 4-[(5-bromo-2-methoxyphenyl)methylidene]-1-(4-fluorophenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 446.27 |
| Molecular Formula: | C21 H17 Br F N O4 |
| Smiles: | CC1=C(/C(=C/c2cc(ccc2OC)[Br])C(N1c1ccc(cc1)F)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.1936 |
| logD: | 4.1936 |
| logSw: | -4.4834 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.129 |
| InChI Key: | ZPKRNQWNPNYCFY-UHFFFAOYSA-N |