6-(2H-1,3-benzodioxol-5-yl)-1,3-dimethyl-4-oxo-4H-cyclohepta[c]furan-8-yl furan-2-carboxylate
Chemical Structure Depiction of
6-(2H-1,3-benzodioxol-5-yl)-1,3-dimethyl-4-oxo-4H-cyclohepta[c]furan-8-yl furan-2-carboxylate
6-(2H-1,3-benzodioxol-5-yl)-1,3-dimethyl-4-oxo-4H-cyclohepta[c]furan-8-yl furan-2-carboxylate
Compound characteristics
| Compound ID: | D132-0057 |
| Compound Name: | 6-(2H-1,3-benzodioxol-5-yl)-1,3-dimethyl-4-oxo-4H-cyclohepta[c]furan-8-yl furan-2-carboxylate |
| Molecular Weight: | 404.37 |
| Molecular Formula: | C23 H16 O7 |
| Smiles: | Cc1c2C(=CC(=CC(c2c(C)o1)=O)c1ccc2c(c1)OCO2)OC(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9137 |
| logD: | 3.9137 |
| logSw: | -4.2165 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.209 |
| InChI Key: | ZESXFKGDURDJLS-UHFFFAOYSA-N |