CAS 154440-77-4

4-(4-chlorophenyl)-1-[4-(4-fluorophenyl)-4-hydroxybutyl]pyridinium

Description:

4-(4-Chlorophenyl)-1-[4-(4-fluorophenyl)-4-hydroxybutyl]pyridinium, with CAS number 154440-77-4, is a chemical compound that belongs to the class of pyridinium derivatives. This substance features a pyridine ring substituted with a chlorophenyl group and a hydroxybutyl chain that is further substituted with a fluorophenyl group. The presence of halogen atoms, such as chlorine and fluorine, often enhances the compound's biological activity and lipophilicity, making it of interest in pharmaceutical research. The hydroxy group contributes to its potential solubility in polar solvents and may influence its interaction with biological targets. Additionally, the structural complexity suggests potential applications in medicinal chemistry, particularly in the development of therapeutic agents. The compound's properties, including its stability, reactivity, and biological activity, would be influenced by its molecular structure, making it a subject of interest for further studies in drug design and development.

Formula: C₂₁H₂₀ClFNO

InChI: InChI=1/C21H20ClFNO/c22-19-7-3-16(4-8-19)17-11-14-24(15-12-17)13-1-2-21(25)18-5-9-20(23)10-6-18/h3-12,14-15,21,25H,1-2,13H2/q+1

SMILES: C(CC(c1ccc(cc1)F)O)Cn1ccc(=C2C=CC(C=C2)Cl)cc1

RHPP+ ion Chloride

Controlled Product

CAS: 154440-77-4

Stability Hygroscopic
Applications RHPP+ ion Chloride a neurotoxic pyridinium metabolite of haloperidol (H103700) that is formed in the liver and found in the brain. Haloperidol pyridinium Chloride (H103770) is a substrate for human organic cation transporters (hOCTs) except for hOCT2.
References Kang, H. et. al.: Drug Metab. Dispos., 34, 1145 (2006)

Formula: C₂₁H₂₀ClFNO·Cl

Color and Shape: Neat

Molecular weight: 392.29

Ref: TR-R314980

Rhpp+ ion chloride

CAS: 154440-77-4

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Formula: C₂₁H₂₀ClFNO

Purity: Min. 95%

Molecular weight: 356.8 g/mol

Ref: 3D-EGA44077