835612-36-7

Basic information

• Product Name: 4-[3-(4-{3-[2-(4-chloro-phenoxymethyl)-4-methyl-benzoimidazol-1-yl]-propyl}-piperidin-1-yl)-propyl]-1-methyl-1,4,6,7-tetrahydro-pyrrolo[3,2-c]pyridine-5-carboxylic acid tert-butyl ester
• Synonyms: 4-[3-(4-{3-[2-(4-chloro-phenoxymethyl)-4-methyl-benzoimidazol-1-yl]-propyl}-piperidin-1-yl)-propyl]-1-methyl-1,4,6,7-tetrahydro-pyrrolo[3,2-c]pyridine-5-carboxylic acid tert-butyl ester
• CAS NO: 835612-36-7
• Molecular Weight: 674.327
• Mol File: 835612-36-7.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: 4-[3-(4-{3-[2-(4-chloro-phenoxymethyl)-4-methyl-benzoimidazol-1-yl]-propyl}-piperidin-1-yl)-propyl]-1-methyl-1,4,6,7-tetrahydro-pyrrolo[3,2-c]pyridine-5-carboxylic acid tert-butyl ester(CAS DataBase Reference)
• NIST Chemistry Reference: 4-[3-(4-{3-[2-(4-chloro-phenoxymethyl)-4-methyl-benzoimidazol-1-yl]-propyl}-piperidin-1-yl)-propyl]-1-methyl-1,4,6,7-tetrahydro-pyrrolo[3,2-c]pyridine-5-carboxylic acid tert-butyl ester(835612-36-7)
• EPA Substance Registry System: 4-[3-(4-{3-[2-(4-chloro-phenoxymethyl)-4-methyl-benzoimidazol-1-yl]-propyl}-piperidin-1-yl)-propyl]-1-methyl-1,4,6,7-tetrahydro-pyrrolo[3,2-c]pyridine-5-carboxylic acid tert-butyl ester(835612-36-7)

Safety Data

• Hazardous Substances Data: 835612-36-7(Hazardous Substances Data)

Upstream product

• 251369-21-8 1-methyl-4-(3-hydroxypropyl)-5-BOC-4,5,6,7-tetrahydro-5-aza-indole 
• 193626-34-5 1-(3-(4-(N-BOC-piperidyl))propyl)-2-(4-chlorophenoxymethyl)-4-methylbenzimidazole 
• 193629-32-2 2-(4-chlorophenoxymethyl)-4-methylbenzimidazole 
• 164149-27-3 tert-butyl 4-(3-bromopropyl)piperidine-1-carboxylate 
• 156185-63-6 N-Boc-piperidin-4-yl-propanol 
• 59007-80-6 2,3-diaminotoluene dihydrochloride 
• 3598-13-8 (4-chlorophenoxy)acetonitrile 
• 83732-75-6 2-(2-Aminoethyl)-1-methylpyrrole 
• 24437-41-0 1-methyl-2-pyrroleacetonitrile 
• 2629-72-3 4-(3-Hydroxypropyl)pyridine 
• 7037-49-2 3-(piperidin-4-yl)propan-1-ol 
• 193626-88-9 1-(3-(4-piperidyl)propyl)-2-(4-chlorophenoxymethyl)-4-methylbenzimidazole 
• 251369-22-9 1-methyl-4-(3-bromopropyl)-5-BOC-4,5,6,7-tetrahydro-5-aza-indole 

Relevant articles and documents

Rapid parallel synthesis applied to the optimization of a series of potent nonpeptide neuropeptide Y-1 receptor antagonists

This study describes the integrated application of parallel synthesis and computational chemistry to the design of potent nonpeptide antagonists for the neuropeptide Y-1 (NPY1) receptor. A lead molecule was modeled in the active site of the NPY1 receptor, and a potentially fruitful region for analog construction was identified. Synthesis of suitable scaffolds followed by solution phase generation of a small library of analogs produced a compound with 5-fold improvement in binding over the already potent lead. This new compound was shown to be an unanticipated side product of the parallel synthesis reaction.