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Chemical structure of Quinidine hydrochloride monohydrate

GC37062

Quinidine hydrochloride monohydrate

Also known as (S)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;hydrate;hydrochloride

Quinidine hydrochloride monohydrate is an anti-arrythmic agent which is also a potent blocker of K+ channel with an IC50 of 19·9 μM

ChemicalCAS6151-40-2MW378.89FormulaC20H27ClN2O3
CAS number
6151-40-2
Molecular weight
378.89
Formula
C20H27ClN2O3
Solubility
DMSO: 100 mg/mL (263·93 mM); Water: 2·5 mg/mL (6·60 mM)
InChIKey
SGVZDMWHXVXUBY-KAIFKDDSSA-N
Catalogue number
GC37062
Brand
GLPBIO
Computed properties PubChem CID 16219921 · TPSA 46.6 Ų · H-bond donors 3 · H-bond acceptors 5
TPSA
46.6 Ų
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
26

SMILES COC1=CC2=C(C=CN=C2C=C1)[C@@H]([C@H]3C[C@@H]4CCN3C[C@@H]4C=C)O.O.Cl

Computed descriptors from PubChem (CID 16219921), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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