3-(2,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl benzoate
Chemical Structure Depiction of
3-(2,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl benzoate
3-(2,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl benzoate
Compound characteristics
| Compound ID: | 4358-3552 |
| Compound Name: | 3-(2,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl benzoate |
| Molecular Weight: | 386.4 |
| Molecular Formula: | C24 H18 O5 |
| Smiles: | Cc1ccc(C)c(c1)OC1=COc2cc(ccc2C1=O)OC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1082 |
| logD: | 5.1082 |
| logSw: | -5.1146 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.034 |
| InChI Key: | RAOXZFDNJIZJAH-UHFFFAOYSA-N |