benzyl ({2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetate
Chemical Structure Depiction of
benzyl ({2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetate
benzyl ({2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetate
Compound characteristics
| Compound ID: | Y041-1166 |
| Compound Name: | benzyl ({2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetate |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C23 H18 O5 S |
| Smiles: | Cc1ccsc1/C=C1/C(c2ccc(cc2O1)OCC(=O)OCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.701 |
| logD: | 4.701 |
| logSw: | -4.8547 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.143 |
| InChI Key: | HUVDGEMJYDYSNR-UHFFFAOYSA-N |