methyl 5-{[(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]methyl}furan-2-carboxylate
Chemical Structure Depiction of
methyl 5-{[(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]methyl}furan-2-carboxylate
methyl 5-{[(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]methyl}furan-2-carboxylate
Compound characteristics
| Compound ID: | Y040-0992 |
| Compound Name: | methyl 5-{[(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]methyl}furan-2-carboxylate |
| Molecular Weight: | 410.81 |
| Molecular Formula: | C22 H15 Cl O6 |
| Smiles: | COC(c1ccc(COc2cc3c(cc2[Cl])C(=CC(=O)O3)c2ccccc2)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8096 |
| logD: | 4.8096 |
| logSw: | -4.9882 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.704 |
| InChI Key: | YIZZCVVCUSCYSU-UHFFFAOYSA-N |