{7-[(3,5-dimethylphenyl)methoxy]-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl}acetic acid
Chemical Structure Depiction of
{7-[(3,5-dimethylphenyl)methoxy]-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl}acetic acid
{7-[(3,5-dimethylphenyl)methoxy]-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl}acetic acid
Compound characteristics
| Compound ID: | D715-0255 |
| Compound Name: | {7-[(3,5-dimethylphenyl)methoxy]-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl}acetic acid |
| Molecular Weight: | 366.41 |
| Molecular Formula: | C22 H22 O5 |
| Smiles: | CC1=C(CC(O)=O)C(=O)Oc2c1ccc(c2C)OCc1cc(C)cc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.952 |
| logD: | 1.4933 |
| logSw: | -4.74 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.542 |
| InChI Key: | QMMVVHBPGVDCQA-UHFFFAOYSA-N |