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Chemical structure of Cipralisant maleate

GC68869

Cipralisant maleate

Also known as (Z)-but-2-enedioic acid;5-[(1R,2R)-2-(5,5-dimethylhex-1-ynyl)cyclopropyl]-1H-imidazole

Cipralisant (GT-2331) (maleate) is an orally active, low-toxicity, effective, selective and high-affinity antagonist of the histamine H3 receptor in vivo· In vitro, it acts as an agonist of the histamine H3 receptor with a pKi value of 9·9 and a Ki value of 0·47 nM for rat histamine H3 receptors· Cipralisant (maleate) has potential in research on attention deficit hyperactivity disorder

ChemicalCAS223420-20-0MW332.39FormulaC18H24N2O4
CAS number
223420-20-0
Molecular weight
332.39
Formula
C18H24N2O4
Solubility
DMSO ： ≥ 100 mg/mL (300·85 mM)
InChIKey
QIQWRCNAPQJQLL-COALEZEGSA-N
Catalogue number
GC68869
Brand
GLPBIO
Computed properties PubChem CID 6450822 · TPSA 103 Ų · H-bond donors 3 · H-bond acceptors 5
TPSA
103 Ų
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
24

SMILES CC(C)(C)CCC#C[C@@H]1C[C@H]1C2=CN=CN2.C(=C\C(=O)O)\C(=O)O

Computed descriptors from PubChem (CID 6450822), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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