Sulfuric acid--6'-methoxycinchonan-9-ol--water (1/1/4)
(S)-[(2R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;sulfuric acid;tetrahydrate
Also Known As: AC1L21MQ|Quinidine hydrogen sulfate tetrahydrate|Sulfuric acid--6'-methoxycinchonan-9-ol--water (1/1/4)|Sulfuric acid--(1xi,9S)-6'-methoxycinchonan-9-ol--water (1/1/4)|(S)-[(2R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol; sulfuric acid; tetrahydrate
| Molecular Formula | C20H34N2O10S |
|---|---|
| Molecular Weight | 494.19342 g/mol |
| LogP | -0.78 |
| Topological Polar Surface Area | 246.19 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 494.19342 |
| Heavy Atoms | 33 |
| Complexity | 980.0 |
Chemical Identifiers
| CAS Number | 6151-39-9 |
|---|---|
| SMILES | COC1=CC2=C(C=CN=C2C=C1)[C@@H]([C@H]3CC4CCN3C[C@@H]4C=C)O.O.O.O.O.OS(=O)(=O)O |
Product Overview
Sulfuric acid--6'-methoxycinchonan-9-ol--water (1/1/4) (CAS 6151-39-9), with molecular formula C20H34N2O10S and molecular weight 494.19342 g/mol. IUPAC: (S)-[(2R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;sulfuric acid;tetrahydrate.
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