methyl 4-({[3-(4-chlorophenyl)-2-methyl-4-oxo-4H-1-benzopyran-7-yl]oxy}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({[3-(4-chlorophenyl)-2-methyl-4-oxo-4H-1-benzopyran-7-yl]oxy}methyl)benzoate
methyl 4-({[3-(4-chlorophenyl)-2-methyl-4-oxo-4H-1-benzopyran-7-yl]oxy}methyl)benzoate
Compound characteristics
| Compound ID: | Y040-4117 |
| Compound Name: | methyl 4-({[3-(4-chlorophenyl)-2-methyl-4-oxo-4H-1-benzopyran-7-yl]oxy}methyl)benzoate |
| Molecular Weight: | 434.88 |
| Molecular Formula: | C25 H19 Cl O5 |
| Smiles: | CC1=C(C(c2ccc(cc2O1)OCc1ccc(cc1)C(=O)OC)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.7296 |
| logD: | 5.7296 |
| logSw: | -5.9686 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.727 |
| InChI Key: | MKOHKWWAJMFPME-UHFFFAOYSA-N |