Azeliragon

Base Information

• Chemical Name: Azeliragon
• CAS No.: 603148-36-3
• Molecular Formula: C32H38ClN3O2
• Molecular Weight: 532.126
• European Community (EC) Number: 814-441-9
• UNII: LPU25F15UQ
• DSSTox Substance ID: DTXSID601117468
• Wikipedia: Azeliragon
• Wikidata: Q27074825
• NCI Thesaurus Code: C174675
• Pharos Ligand ID: QA4YV6MD1WSC
• Metabolomics Workbench ID: 153632
• ChEMBL ID: CHEMBL3989929
• Mol file: 603148-36-3.mol

Synonyms:1-Propanamine, 3-(4-(2-butyl-1-(4-(4-chlorophenoxy)phenyl)-1H-imidazol-4-yl)phenoxy)-N,N-diethyl-;3-(4-(2-Butyl-1-(4-(4-chlorophenoxy)phenyl)-1H-imidazol-4-yl)phenoxy)-N,N-diethyl-1-propanamine;azeliragon;TTP488

Chemical Property of Azeliragon

Chemical Property:

• Vapor Pressure: 1.08E-17mmHg at 25°C
• Refractive Index: 1.572
• Boiling Point: 667.7 °C at 760 mmHg
• PKA: 10.16±0.25(Predicted)
• Flash Point: 357.6 °C
• PSA: 39.52000
• Density: 1.11 g/cm³
• LogP: 8.43830
• XLogP3: 8.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 14
• Exact Mass: 531.2652552
• Heavy Atom Count: 38
• Complexity: 626

Purity/Quality:

98%Min ^*data from raw suppliers

Azeliragon（PF-04494700,TTP488） >98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC1=NC(=CN1C2=CC=C(C=C2)OC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OCCCN(CC)CC
• Recent ClinicalTrials: Phase 2 Study of Azeliragon in MGMT Unmethylated Glioblastoma
• Recent EU Clinical Trials: A Phase I/II Open Label Study to Assess Safety and Preliminary Evidence of a Therapeutic Effect of Azeliragon Combined with Conventional Concurrent Radiation and Temozolomide in Patients with Newly Diagnosed Glioblastoma

Technology Process of Azeliragon

There total 1 articles about Azeliragon which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

4-{2-butyl-1-[4-(4-chlorophenoxy)phenyl]-1H-imidazol-4-yl}phenol (1067425-96-0) + 3-diethylaminopropyl chloride (104-77-8) → [3-(4-{2-butyl-1-[4-(4-chloro-phenoxy)-phenyl]-1H-imidazol-4-yl}-phenoxy)-propyl]-diethylamine (603148-36-3)

Guidance literature:

With potassium carbonate; In acetone; Heating / reflux;

Reference yield:

[3-(4-{2-butyl-1-[4-(4-chloro-phenoxy)-phenyl]-1H-imidazol-4-yl}-phenoxy)-propyl]-diethylamine (603148-36-3) → C32H38ClN3O2*1.05BrH

Guidance literature:

With hydrogen bromide; In ethanol; at 20 ℃;

Reference yield:

[3-(4-{2-butyl-1-[4-(4-chloro-phenoxy)-phenyl]-1H-imidazol-4-yl}-phenoxy)-propyl]-diethylamine (603148-36-3) → C32H38ClN3O2*2.07BrH

Guidance literature:

With hydrogen bromide; In tert-butyl methyl ether; at 20 ℃;

upstream raw materials:

4-{2-butyl-1-[4-(4-chlorophenoxy)phenyl]-1H-imidazol-4-yl}phenol

3-diethylaminopropyl chloride

Refernces