509093-77-0

Basic information

• Product Name: N-(1-Phenyl-5-[(piperidin-1-yl)methyl]-1H-benzimidazol-2-yl)-3-nitrobenzamide
• Synonyms: 3-Nitro-N-[1-phenyl-5-(1-piperidinylmethyl)-1H-benzimidazol-2-yl]benzamide;N-(1-Phenyl-5-[(piperidin-1-yl)methyl]-1H-benzimidazol-2-yl)-3-nitrobenzamide
• CAS NO: 509093-77-0
• Molecular Formula: C₂₆H₂₅N₅O₃
• Molecular Weight: 455.5084
• Mol File: 509093-77-0.mol
• Article Data: 2

Chemical Properties

• Appearance: /
• Density: 1.33
• PKA: 11.31±0.43(Predicted)
• CAS DataBase Reference: N-(1-Phenyl-5-[(piperidin-1-yl)methyl]-1H-benzimidazol-2-yl)-3-nitrobenzamide(CAS DataBase Reference)
• NIST Chemistry Reference: N-(1-Phenyl-5-[(piperidin-1-yl)methyl]-1H-benzimidazol-2-yl)-3-nitrobenzamide(509093-77-0)
• EPA Substance Registry System: N-(1-Phenyl-5-[(piperidin-1-yl)methyl]-1H-benzimidazol-2-yl)-3-nitrobenzamide(509093-77-0)

Safety Data

• Hazardous Substances Data: 509093-77-0(Hazardous Substances Data)

Upstream product

• 509093-76-9 1-phenyl-5-piperidin-1-ylmethyl-1H-benzoimidazol-2-ylamine 
• 121-92-6 3-nitrobenzoic acid 
• 20274-69-5 (4-fluoro-3-nitrophenyl)methanol 
• 453-71-4 3-nitro-4-fluorobenzoic acid 
• 42564-51-2 4-fluoro-3-nitrobenzaldehyde 
• 509093-74-7 1-[(4-fluoro-3-nitrophenyl)methyl]piperidine 

Relevant articles and documents

Discovery of potent, selective, and orally bioavailable inhibitors of interleukin-1 receptor-associate kinase-4

In this Letter, we report the continued optimization of the N-acyl-2-aminobenzimidazole series, focusing in particular on the N-alkyl substituent and 5-position of the benzimidazole based on the binding mode and the early SAR. These efforts led to the discovery of 16, a highly potent, selective, and orally bioavailable inhibitor of IRAK-4.