benzyl [(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetate
Chemical Structure Depiction of
benzyl [(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetate
benzyl [(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetate
Compound characteristics
| Compound ID: | Y042-8176 |
| Compound Name: | benzyl [(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetate |
| Molecular Weight: | 420.85 |
| Molecular Formula: | C24 H17 Cl O5 |
| Smiles: | C(C(=O)OCc1ccccc1)Oc1cc2c(cc1[Cl])C(=CC(=O)O2)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0639 |
| logD: | 5.0639 |
| logSw: | -5.3734 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.223 |
| InChI Key: | XFHJKOXRJBMOPC-UHFFFAOYSA-N |