methyl 4-{[(3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]methyl}-5-methylfuran-2-carboxylate
Chemical Structure Depiction of
methyl 4-{[(3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]methyl}-5-methylfuran-2-carboxylate
methyl 4-{[(3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]methyl}-5-methylfuran-2-carboxylate
Compound characteristics
| Compound ID: | 4986-1188 |
| Compound Name: | methyl 4-{[(3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]methyl}-5-methylfuran-2-carboxylate |
| Molecular Weight: | 418.45 |
| Molecular Formula: | C25 H22 O6 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2cc(ccc12)OCc1cc(C(=O)OC)oc1C |
| Stereo: | ACHIRAL |
| logP: | 4.733 |
| logD: | 4.733 |
| logSw: | -4.8444 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.615 |
| InChI Key: | AYYOABCXWKSFDN-UHFFFAOYSA-N |