2-[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoic acid
Chemical Structure Depiction of
2-[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoic acid
2-[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoic acid
Compound characteristics
| Compound ID: | 4182-0250 |
| Compound Name: | 2-[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoic acid |
| Molecular Weight: | 352.39 |
| Molecular Formula: | C21 H20 O5 |
| Smiles: | CC(C(O)=O)Oc1ccc2C(C)=C(Cc3ccccc3)C(=O)Oc2c1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.353 |
| logD: | 0.3536 |
| logSw: | -4.5273 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.857 |
| InChI Key: | YCSRGPBZJGMZSN-AWEZNQCLSA-N |