869096-85-5

Basic information

• Product Name: (2-trimethylsilanylethyl)-3-cyano-5-(4-methoxybenzyl)benzoate
• Synonyms: (2-trimethylsilanylethyl)-3-cyano-5-(4-methoxybenzyl)benzoate
• CAS NO: 869096-85-5
• Molecular Weight: 367.52
• Mol File: 869096-85-5.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: (2-trimethylsilanylethyl)-3-cyano-5-(4-methoxybenzyl)benzoate(CAS DataBase Reference)
• NIST Chemistry Reference: (2-trimethylsilanylethyl)-3-cyano-5-(4-methoxybenzyl)benzoate(869096-85-5)
• EPA Substance Registry System: (2-trimethylsilanylethyl)-3-cyano-5-(4-methoxybenzyl)benzoate(869096-85-5)

Safety Data

• Hazardous Substances Data: 869096-85-5(Hazardous Substances Data)

Upstream product

• 188815-32-9 3-bromo-5-iodo-benzoic acid 
• 869096-80-0 3-bromo-5-iodo-4'-methoxybenzophenone 
• 869096-82-2 1-bromo-3-iodo-5-(4-methoxybenzyl)benzene 
• 810681-06-2 3-bromo-5-iodobenzoyl chloride 
• 869096-84-4 (2-trimethylsilanylethyl)-3-bromo-5-(4-methoxybenzyl)benzoate 
• 557-21-1 dicyanozinc 

Relevant articles and documents

Angiotensin II pseudopeptides containing 1,3,5-trisubstituted benzene scaffolds with high AT2 receptor affinity

Two 1,3,5-trisubstituted aromatic scaffolds intended to serve as γ-turn mimetics have been synthesized and incorporated in five pseudopeptide analogues of angiotensin II (Asp-Arg-Val-Tyr-Ile-His-Pro-Phe), replacing Val-Tyr-Ile, Val-Tyr, or Tyr-Ile. All the tested compounds exhibited nanomolar affinity for the AT2 receptor with the best compound (3) having a Ki of 1.85 nM. Four pseudopeptides were AT2 selective, while one (5) also exhibited good affinity for the AT1 receptor (Ki = 30.3 nM). This pseudopeptide exerted full agonistic activity in an AT2 receptor induced neurite outgrowth assay but displayed no agonistic effect in an AT1 receptor functional assay. Molecular modeling, using the program DISCOtech, showed that the high-affinity ligands could interact similarly with the AT2 receptor as other ligands with high affinity for this receptor. A tentative agonist model is proposed for AT2 receptor activation by angiotensin II analogues. We conclude that the 1,3,5-trisubstituted benzene rings can be conveniently prepared and are suitable as γ-turn mimics.