3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g][1]benzopyran-3-yl)propanoic acid
Chemical Structure Depiction of
3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g][1]benzopyran-3-yl)propanoic acid
3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g][1]benzopyran-3-yl)propanoic acid
Compound characteristics
| Compound ID: | D143-0308 |
| Compound Name: | 3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g][1]benzopyran-3-yl)propanoic acid |
| Molecular Weight: | 340.37 |
| Molecular Formula: | C20 H20 O5 |
| Smiles: | CC1=C(CCC(O)=O)C(=O)Oc2c1cc1c3CCCCc3oc1c2C |
| Stereo: | ACHIRAL |
| logP: | 3.7789 |
| logD: | 1.2827 |
| logSw: | -3.9775 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.577 |
| InChI Key: | LTNQBFQMHGWUED-UHFFFAOYSA-N |