methyl 4-{[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]methyl}-5-methylfuran-2-carboxylate
Chemical Structure Depiction of
methyl 4-{[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]methyl}-5-methylfuran-2-carboxylate
methyl 4-{[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]methyl}-5-methylfuran-2-carboxylate
Compound characteristics
| Compound ID: | 4986-1189 |
| Compound Name: | methyl 4-{[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]methyl}-5-methylfuran-2-carboxylate |
| Molecular Weight: | 432.47 |
| Molecular Formula: | C26 H24 O6 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2c1ccc(c2C)OCc1cc(C(=O)OC)oc1C |
| Stereo: | ACHIRAL |
| logP: | 5.3082 |
| logD: | 5.3082 |
| logSw: | -5.5044 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.386 |
| InChI Key: | JRRPQUYFWFFBQQ-UHFFFAOYSA-N |