benzyl [(3-benzyl-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetate
Chemical Structure Depiction of
benzyl [(3-benzyl-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetate
benzyl [(3-benzyl-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetate
Compound characteristics
| Compound ID: | Y040-1469 |
| Compound Name: | benzyl [(3-benzyl-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetate |
| Molecular Weight: | 428.48 |
| Molecular Formula: | C27 H24 O5 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2cc(C)cc(c12)OCC(=O)OCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.7634 |
| logD: | 5.7634 |
| logSw: | -5.6118 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.737 |
| InChI Key: | HMKUPNWHYDEIJZ-UHFFFAOYSA-N |