1241946-96-2

Basic information

• Product Name: C₁₄H₁₀BrClFNO
• Synonyms: C₁₄H₁₀BrClFNO
• CAS NO: 1241946-96-2
• Molecular Weight: 342.595
• Mol File: 1241946-96-2.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: C₁₄H₁₀BrClFNO(CAS DataBase Reference)
• NIST Chemistry Reference: C₁₄H₁₀BrClFNO(1241946-96-2)
• EPA Substance Registry System: C₁₄H₁₀BrClFNO(1241946-96-2)

Safety Data

• Hazardous Substances Data: 1241946-96-2(Hazardous Substances Data)

Upstream product

• 1096296-85-3 (5-bromo-2-chloro-phenyl)methanamine 
• 403-43-0 4-fluorobenzoyl chloride 

Downstream Products

• 1241946-97-3 C₂₀H₂₂BClFNO₃ 

Relevant articles and documents

Diazinones as P2 replacements for pyrazole-based cathepsin S inhibitors

A pyridazin-4-one fragment 4 (hCatS IC50 = 170 μM) discovered through Tethering was modeled into cathepsin S and predicted to overlap in S2 with the tetrahydropyridinepyrazole core of a previously disclosed series of CatS inhibitors. This fragment served as a template to design pyridazin-3-one 12 (hCatS IC50 = 430 nM), which also incorporates P3 and P5 binding elements. A crystal structure of 12 bound to Cys25Ser CatS led to the synthesis of the potent diazinone isomers 22 (hCatS IC50 = 60 nM) and 27 (hCatS IC50 = 40 nM).