methyl 4-{[(2-methyl-4-oxo-3-phenoxy-4H-1-benzopyran-7-yl)oxy]methyl}benzoate
Chemical Structure Depiction of
methyl 4-{[(2-methyl-4-oxo-3-phenoxy-4H-1-benzopyran-7-yl)oxy]methyl}benzoate
methyl 4-{[(2-methyl-4-oxo-3-phenoxy-4H-1-benzopyran-7-yl)oxy]methyl}benzoate
Compound characteristics
| Compound ID: | Y041-1983 |
| Compound Name: | methyl 4-{[(2-methyl-4-oxo-3-phenoxy-4H-1-benzopyran-7-yl)oxy]methyl}benzoate |
| Molecular Weight: | 416.43 |
| Molecular Formula: | C25 H20 O6 |
| Smiles: | CC1=C(C(c2ccc(cc2O1)OCc1ccc(cc1)C(=O)OC)=O)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1465 |
| logD: | 5.1465 |
| logSw: | -5.2412 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.064 |
| InChI Key: | IYGXKRPMGVTNBW-UHFFFAOYSA-N |