methyl 4-{[(6-hexyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]methyl}benzoate
Chemical Structure Depiction of
methyl 4-{[(6-hexyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]methyl}benzoate
methyl 4-{[(6-hexyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]methyl}benzoate
Compound characteristics
| Compound ID: | Y040-7260 |
| Compound Name: | methyl 4-{[(6-hexyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]methyl}benzoate |
| Molecular Weight: | 470.57 |
| Molecular Formula: | C30 H30 O5 |
| Smiles: | CCCCCCc1cc2C(=CC(=O)Oc2cc1OCc1ccc(cc1)C(=O)OC)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 7.7483 |
| logD: | 7.7483 |
| logSw: | -5.8211 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.862 |
| InChI Key: | BDMILPUGILWGHM-UHFFFAOYSA-N |