methyl 2-({2-[(4-bromophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)propanoate
Chemical Structure Depiction of
methyl 2-({2-[(4-bromophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)propanoate
methyl 2-({2-[(4-bromophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)propanoate
Compound characteristics
| Compound ID: | Y041-4540 |
| Compound Name: | methyl 2-({2-[(4-bromophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)propanoate |
| Molecular Weight: | 403.23 |
| Molecular Formula: | C19 H15 Br O5 |
| Smiles: | CC(C(=O)OC)Oc1ccc2C(/C(=C/c3ccc(cc3)[Br])Oc2c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2236 |
| logD: | 4.2236 |
| logSw: | -4.5055 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.326 |
| InChI Key: | HDVOYXXURQRTSK-NSHDSACASA-N |