methyl 4-{[(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]methyl}-5-methylfuran-2-carboxylate
Chemical Structure Depiction of
methyl 4-{[(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]methyl}-5-methylfuran-2-carboxylate
methyl 4-{[(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]methyl}-5-methylfuran-2-carboxylate
Compound characteristics
| Compound ID: | 4986-1197 |
| Compound Name: | methyl 4-{[(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]methyl}-5-methylfuran-2-carboxylate |
| Molecular Weight: | 424.84 |
| Molecular Formula: | C23 H17 Cl O6 |
| Smiles: | Cc1c(COc2cc3c(cc2[Cl])C(=CC(=O)O3)c2ccccc2)cc(C(=O)OC)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.7973 |
| logD: | 4.7973 |
| logSw: | -4.9715 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.188 |
| InChI Key: | LWPWGTUCFBUWSN-UHFFFAOYSA-N |