methyl 4-{[(8-methyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]methyl}benzoate
Chemical Structure Depiction of
methyl 4-{[(8-methyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]methyl}benzoate
methyl 4-{[(8-methyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]methyl}benzoate
Compound characteristics
Compound ID: | 3330-4227 |
Compound Name: | methyl 4-{[(8-methyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]methyl}benzoate |
Molecular Weight: | 400.43 |
Molecular Formula: | C25 H20 O5 |
Smiles: | Cc1c(ccc2C(=CC(=O)Oc12)c1ccccc1)OCc1ccc(cc1)C(=O)OC |
Stereo: | ACHIRAL |
logP: | 5.1435 |
logD: | 5.1435 |
logSw: | -5.2739 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 48.547 |
InChI Key: | UERATCLCMHZRSU-UHFFFAOYSA-N |