methyl 4-{[(7-methyl-2-oxo-4-phenyl-2H-1-benzopyran-5-yl)oxy]methyl}benzoate
Chemical Structure Depiction of
methyl 4-{[(7-methyl-2-oxo-4-phenyl-2H-1-benzopyran-5-yl)oxy]methyl}benzoate
methyl 4-{[(7-methyl-2-oxo-4-phenyl-2H-1-benzopyran-5-yl)oxy]methyl}benzoate
Compound characteristics
| Compound ID: | Y040-7281 |
| Compound Name: | methyl 4-{[(7-methyl-2-oxo-4-phenyl-2H-1-benzopyran-5-yl)oxy]methyl}benzoate |
| Molecular Weight: | 400.43 |
| Molecular Formula: | C25 H20 O5 |
| Smiles: | Cc1cc(c2C(=CC(=O)Oc2c1)c1ccccc1)OCc1ccc(cc1)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.2819 |
| logD: | 5.2819 |
| logSw: | -5.4904 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.862 |
| InChI Key: | VJEQXMQCRBHFMO-UHFFFAOYSA-N |