methyl 4-[({2-[(5-bromo-2-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)methyl]benzoate
Chemical Structure Depiction of
methyl 4-[({2-[(5-bromo-2-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)methyl]benzoate
methyl 4-[({2-[(5-bromo-2-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)methyl]benzoate
Compound characteristics
| Compound ID: | Y041-1159 |
| Compound Name: | methyl 4-[({2-[(5-bromo-2-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)methyl]benzoate |
| Molecular Weight: | 495.33 |
| Molecular Formula: | C25 H19 Br O6 |
| Smiles: | COC(c1ccc(COc2ccc3C(/C(=C/c4cc(ccc4OC)[Br])Oc3c2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9432 |
| logD: | 5.9432 |
| logSw: | -5.6277 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.395 |
| InChI Key: | GDBOGJBPMNGHFL-UHFFFAOYSA-N |