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Chemical structure of Pitolisant oxalate

GC36932

Pitolisant oxalate

Also known as 1-[3-[3-(4-chlorophenyl)propoxy]propyl]piperidine;oxalic acid

Pitolisant oxalate is a potent and selective nonimidazole inverse agonist at the recombinant human histamine H3 receptor (Ki=0·16 nM)

ChemicalCAS362665-57-4MW385.88FormulaC19H28ClNO5
CAS number
362665-57-4
Molecular weight
385.88
Formula
C19H28ClNO5
Solubility
DMSO： 50 mg/mL (129·57 mM)
InChIKey
OZTKSXOIWBLDBB-UHFFFAOYSA-N
Catalogue number
GC36932
Brand
GLPBIO
Computed properties PubChem CID 23137286 · TPSA 87.1 Ų · H-bond donors 2 · H-bond acceptors 6
TPSA
87.1 Ų
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
26

SMILES C1CCN(CC1)CCCOCCCC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

Computed descriptors from PubChem (CID 23137286), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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