6'-Methoxycinchonan-9-ol--water (1/2)
(S)-[(2R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;dihydrate
Also Known As: Quinidine dihydrate|Quinidine, dihydrate|AC1L21P8|6'-Methoxycinchonan-9-ol--water (1/2)|Cinchonan-9-ol, 6'-methoxy-, dihydrate (9S)-|(1xi,9S)-6'-Methoxycinchonan-9-ol--water (1/2)|(S)-[(2R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol dihydrate
| Molecular Formula | C20H28N2O4 |
|---|---|
| Molecular Weight | 360.2049 g/mol |
| LogP | 1.52 |
| Topological Polar Surface Area | 108.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 360.2049 |
| Heavy Atoms | 26 |
| Complexity | 766.6 |
Chemical Identifiers
| CAS Number | 63717-04-4 |
|---|---|
| SMILES | COC1=CC2=C(C=CN=C2C=C1)[C@@H]([C@H]3CC4CCN3C[C@@H]4C=C)O.O.O |
Product Overview
6'-Methoxycinchonan-9-ol--water (1/2) (CAS 63717-04-4), with molecular formula C20H28N2O4 and molecular weight 360.2049 g/mol. IUPAC: (S)-[(2R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;dihydrate.
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