3-[(2H-1,3-benzodioxol-5-yl)methylidene]-5-(4-methylphenyl)furan-2(3H)-one
Chemical Structure Depiction of
3-[(2H-1,3-benzodioxol-5-yl)methylidene]-5-(4-methylphenyl)furan-2(3H)-one
3-[(2H-1,3-benzodioxol-5-yl)methylidene]-5-(4-methylphenyl)furan-2(3H)-one
Compound characteristics
| Compound ID: | 4989-0006 |
| Compound Name: | 3-[(2H-1,3-benzodioxol-5-yl)methylidene]-5-(4-methylphenyl)furan-2(3H)-one |
| Molecular Weight: | 306.32 |
| Molecular Formula: | C19 H14 O4 |
| Smiles: | Cc1ccc(cc1)C1=C/C(=C/c2ccc3c(c2)OCO3)C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 4.4791 |
| logD: | 4.4791 |
| logSw: | -4.4502 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.855 |
| InChI Key: | QPOLRXUIFOOONE-UHFFFAOYSA-N |