[(3-benzyl-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetic acid
Chemical Structure Depiction of
[(3-benzyl-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetic acid
[(3-benzyl-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetic acid
Compound characteristics
| Compound ID: | 4182-0318 |
| Compound Name: | [(3-benzyl-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetic acid |
| Molecular Weight: | 338.36 |
| Molecular Formula: | C20 H18 O5 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2cc(C)cc(c12)OCC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0684 |
| logD: | -0.1685 |
| logSw: | -4.4084 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.858 |
| InChI Key: | BUXSBYXHQMQTOF-UHFFFAOYSA-N |