methyl 5-{3-[(3-bromo-4-methoxyphenyl)methylidene]-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl}-2-chlorobenzoate
Chemical Structure Depiction of
methyl 5-{3-[(3-bromo-4-methoxyphenyl)methylidene]-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl}-2-chlorobenzoate
methyl 5-{3-[(3-bromo-4-methoxyphenyl)methylidene]-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl}-2-chlorobenzoate
Compound characteristics
| Compound ID: | 2150-0567 |
| Compound Name: | methyl 5-{3-[(3-bromo-4-methoxyphenyl)methylidene]-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl}-2-chlorobenzoate |
| Molecular Weight: | 524.8 |
| Molecular Formula: | C26 H19 Br Cl N O4 |
| Smiles: | COC(c1cc(ccc1[Cl])N1C(=C/C(=C\c2ccc(c(c2)[Br])OC)C1=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0356 |
| logD: | 6.0356 |
| logSw: | -6.0767 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.852 |
| InChI Key: | KFKHHJQNQFYWCT-UHFFFAOYSA-N |