[(8,8-dimethyl-2-oxo-4-phenyl-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-5-yl)oxy]acetic acid
Chemical Structure Depiction of
[(8,8-dimethyl-2-oxo-4-phenyl-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-5-yl)oxy]acetic acid
[(8,8-dimethyl-2-oxo-4-phenyl-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-5-yl)oxy]acetic acid
Compound characteristics
| Compound ID: | Y042-9888 |
| Compound Name: | [(8,8-dimethyl-2-oxo-4-phenyl-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-5-yl)oxy]acetic acid |
| Molecular Weight: | 380.4 |
| Molecular Formula: | C22 H20 O6 |
| Smiles: | CC1(C)CCc2c(cc(c3C(=CC(=O)Oc23)c2ccccc2)OCC(O)=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 3.788 |
| logD: | -0.449 |
| logSw: | -4.4585 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.361 |
| InChI Key: | ZPJMOXSPTXNRIX-UHFFFAOYSA-N |