2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 3,4-dimethoxybenzoate
Chemical Structure Depiction of
2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 3,4-dimethoxybenzoate
2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 3,4-dimethoxybenzoate
Compound characteristics
| Compound ID: | Y041-1256 |
| Compound Name: | 2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 3,4-dimethoxybenzoate |
| Molecular Weight: | 422.46 |
| Molecular Formula: | C23 H18 O6 S |
| Smiles: | Cc1ccsc1/C=C1/C(c2ccc(cc2O1)OC(c1ccc(c(c1)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2338 |
| logD: | 4.2338 |
| logSw: | -4.4924 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.02 |
| InChI Key: | VFUKEAHFBGSFRE-UHFFFAOYSA-N |