[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetic acid
Chemical Structure Depiction of
[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetic acid
[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetic acid
Compound characteristics
| Compound ID: | 4182-0247 |
| Compound Name: | [(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetic acid |
| Molecular Weight: | 338.36 |
| Molecular Formula: | C20 H18 O5 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2c1ccc(c2C)OCC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8798 |
| logD: | -0.3571 |
| logSw: | -4.1251 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.542 |
| InChI Key: | XBWXIAFVOFIVEA-UHFFFAOYSA-N |