333988-07-1

Basic information

• Product Name: Piperidine, 1-acetyl-4-[[4-(methylthio)phenyl]methyl]-
• CAS NO: 333988-07-1
• Molecular Formula: C15H21NOS
• Molecular Weight: 263.404
• Mol File: 333988-07-1.mol
• Article Data: 2

Chemical Properties

• CAS DataBase Reference: Piperidine, 1-acetyl-4-[[4-(methylthio)phenyl]methyl]-(CAS DataBase Reference)
• NIST Chemistry Reference: Piperidine, 1-acetyl-4-[[4-(methylthio)phenyl]methyl]-(333988-07-1)
• EPA Substance Registry System: Piperidine, 1-acetyl-4-[[4-(methylthio)phenyl]methyl]-(333988-07-1)

Safety Data

• Hazardous Substances Data: 333988-07-1(Hazardous Substances Data)

Upstream product

• 333795-03-2 4-[(1-acetyl-4-piperidinyl)methyl]benzenesulfonyl chloride 
• 333987-97-6 4-[(1-acetylpiperidin-4-yl)methyl]benzenethiol 
• 74-88-4 methyl iodide 
• 101997-42-6 1-(4-benzylpiperidin-1-yl)ethan-1-one 
• 31252-42-3 4-benzylpyperidine 

Downstream Products

• 333988-08-2 4-(4-methylsulfanylbenzyl)piperidine 

Relevant articles and documents

CCR5 antagonists as anti-HIV-1 agents. Part 3: Synthesis and biological evaluation of piperidine-4-carboxamide derivatives

Replacement of the 5-oxopyrrolidin-3-yl fragment in the previously reported lead structure with a 1-acetylpiperidin-4-yl group led to the discovery of a novel series of potent CCR5 antagonists. Introduction of small hydrophobic substituents on the central phenyl ring increased the binding affinity, providing low to sub-nanomolar CCR5 antagonists. The selected compound 11f showed excellent antiviral activity against CCR5-using HIV-1 replication in human peripheral blood mononuclear cells (EC50 = 0.59 nM) and an acceptable pharmacokinetic profile in dogs.