methyl 3-(3-hydroxy-4-methoxyphenyl)-3-(3-hydroxy-6-{[(4-methoxyphenyl)sulfanyl]methyl}-4-oxo-4H-pyran-2-yl)propanoate
Chemical Structure Depiction of
methyl 3-(3-hydroxy-4-methoxyphenyl)-3-(3-hydroxy-6-{[(4-methoxyphenyl)sulfanyl]methyl}-4-oxo-4H-pyran-2-yl)propanoate
methyl 3-(3-hydroxy-4-methoxyphenyl)-3-(3-hydroxy-6-{[(4-methoxyphenyl)sulfanyl]methyl}-4-oxo-4H-pyran-2-yl)propanoate
Compound characteristics
| Compound ID: | 8020-7453 |
| Compound Name: | methyl 3-(3-hydroxy-4-methoxyphenyl)-3-(3-hydroxy-6-{[(4-methoxyphenyl)sulfanyl]methyl}-4-oxo-4H-pyran-2-yl)propanoate |
| Molecular Weight: | 472.51 |
| Molecular Formula: | C24 H24 O8 S |
| Smiles: | COC(CC(C1=C(C(C=C(CSc2ccc(cc2)OC)O1)=O)O)c1ccc(c(c1)O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2296 |
| logD: | 3.1389 |
| logSw: | -3.2073 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.479 |
| InChI Key: | RPTCRJSPERIVIL-SFHVURJKSA-N |