3-{7-[(2-methoxyphenyl)methoxy]-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl}propanoic acid
Chemical Structure Depiction of
3-{7-[(2-methoxyphenyl)methoxy]-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl}propanoic acid
3-{7-[(2-methoxyphenyl)methoxy]-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl}propanoic acid
Compound characteristics
| Compound ID: | D715-0032 |
| Compound Name: | 3-{7-[(2-methoxyphenyl)methoxy]-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl}propanoic acid |
| Molecular Weight: | 382.41 |
| Molecular Formula: | C22 H22 O6 |
| Smiles: | CC1=C(CCC(O)=O)C(=O)Oc2c1ccc(c2C)OCc1ccccc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.8511 |
| logD: | 1.3548 |
| logSw: | -3.989 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.173 |
| InChI Key: | RUBSNRMGHFYHBF-UHFFFAOYSA-N |