6-(3,4-dihydroxyphenyl)-8-methoxy-1,3-dimethyl-4H-cyclohepta[c]furan-4-one
Chemical Structure Depiction of
6-(3,4-dihydroxyphenyl)-8-methoxy-1,3-dimethyl-4H-cyclohepta[c]furan-4-one
6-(3,4-dihydroxyphenyl)-8-methoxy-1,3-dimethyl-4H-cyclohepta[c]furan-4-one
Compound characteristics
Compound ID: | 3998-0021 |
Compound Name: | 6-(3,4-dihydroxyphenyl)-8-methoxy-1,3-dimethyl-4H-cyclohepta[c]furan-4-one |
Molecular Weight: | 312.32 |
Molecular Formula: | C18 H16 O5 |
Smiles: | Cc1c2C(=CC(=CC(c2c(C)o1)=O)c1ccc(c(c1)O)O)OC |
Stereo: | ACHIRAL |
logP: | 2.5519 |
logD: | 2.5435 |
logSw: | -2.4646 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 61.777 |
InChI Key: | UAQFDYHJIVFMOZ-UHFFFAOYSA-N |