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Chemical structure of RS 16566 dihydrochloride

GC15979

RS 16566 dihydrochloride

Also known as N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-6-chloro-1-propan-2-ylbenzimidazole-4-carboxamide;dihydrochloride

ligand for the (R)-zacopride binding site

ChemicalCAS1217788-97-0MW419.78FormulaC18H23ClN4O·2HCl
CAS number
1217788-97-0
Molecular weight
419.78
Formula
C18H23ClN4O·2HCl
Solubility
＜4·2mg/ml in Water
InChIKey
LPEOWDMQSXDYRJ-CKUXDGONSA-N
Catalogue number
GC15979
Brand
GLPBIO
Computed properties PubChem CID 90479748 · TPSA 50.2 Ų · H-bond donors 3 · H-bond acceptors 3
TPSA
50.2 Ų
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
26

SMILES CC(C)N1C=NC2=C(C=C(C=C21)Cl)C(=O)N[C@H]3CN4CCC3CC4.Cl.Cl

Computed descriptors from PubChem (CID 90479748), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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