3-[(2H-1,3-benzodioxol-5-yl)methylidene]-5-(2,4-dimethoxyphenyl)furan-2(3H)-one
Chemical Structure Depiction of
3-[(2H-1,3-benzodioxol-5-yl)methylidene]-5-(2,4-dimethoxyphenyl)furan-2(3H)-one
3-[(2H-1,3-benzodioxol-5-yl)methylidene]-5-(2,4-dimethoxyphenyl)furan-2(3H)-one
Compound characteristics
| Compound ID: | 5639-0225 |
| Compound Name: | 3-[(2H-1,3-benzodioxol-5-yl)methylidene]-5-(2,4-dimethoxyphenyl)furan-2(3H)-one |
| Molecular Weight: | 352.34 |
| Molecular Formula: | C20 H16 O6 |
| Smiles: | COc1ccc(C2=C/C(=C/c3ccc4c(c3)OCO4)C(=O)O2)c(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 3.8948 |
| logD: | 3.8948 |
| logSw: | -4.106 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.029 |
| InChI Key: | SRPWIISSHHBMAU-UHFFFAOYSA-N |