3-(5,9-dimethyl-7-oxo-3-phenyl-7H-furo[3,2-g][1]benzopyran-6-yl)propanoic acid
Chemical Structure Depiction of
3-(5,9-dimethyl-7-oxo-3-phenyl-7H-furo[3,2-g][1]benzopyran-6-yl)propanoic acid
3-(5,9-dimethyl-7-oxo-3-phenyl-7H-furo[3,2-g][1]benzopyran-6-yl)propanoic acid
Compound characteristics
Compound ID: | D143-0297 |
Compound Name: | 3-(5,9-dimethyl-7-oxo-3-phenyl-7H-furo[3,2-g][1]benzopyran-6-yl)propanoic acid |
Molecular Weight: | 362.38 |
Molecular Formula: | C22 H18 O5 |
Smiles: | CC1=C(CCC(O)=O)C(=O)Oc2c1cc1c(coc1c2C)c1ccccc1 |
Stereo: | ACHIRAL |
logP: | 4.307 |
logD: | 1.8107 |
logSw: | -4.3427 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.749 |
InChI Key: | WKCPIBFTVGPWMQ-UHFFFAOYSA-N |