6-(3,4-dimethoxyphenyl)-1,3-dimethyl-4-oxo-4H-cyclohepta[c]furan-8-yl benzoate
Chemical Structure Depiction of
6-(3,4-dimethoxyphenyl)-1,3-dimethyl-4-oxo-4H-cyclohepta[c]furan-8-yl benzoate
6-(3,4-dimethoxyphenyl)-1,3-dimethyl-4-oxo-4H-cyclohepta[c]furan-8-yl benzoate
Compound characteristics
| Compound ID: | D132-0042 |
| Compound Name: | 6-(3,4-dimethoxyphenyl)-1,3-dimethyl-4-oxo-4H-cyclohepta[c]furan-8-yl benzoate |
| Molecular Weight: | 430.46 |
| Molecular Formula: | C26 H22 O6 |
| Smiles: | Cc1c2C(=CC(=CC(c2c(C)o1)=O)c1ccc(c(c1)OC)OC)OC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3875 |
| logD: | 4.3875 |
| logSw: | -4.6649 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.776 |
| InChI Key: | JSDCIHBEAZGADB-UHFFFAOYSA-N |