4-(6-Methoxy-2-(4-methoxyphenyl)benzofuran-3-carbonyl)benzonitrile

Base Information

• Chemical Name: 4-(6-Methoxy-2-(4-methoxyphenyl)benzofuran-3-carbonyl)benzonitrile
• CAS No.: 176977-56-3
• Molecular Formula: C₂₄H₁₇NO₄
• Molecular Weight: 383.403
• Hs Code.: 2932999099
• European Community (EC) Number: 664-046-9
• UNII: CJY03984CT
• DSSTox Substance ID: DTXSID901027464
• Nikkaji Number: J939.888K
• Wikipedia: LY-320,135
• Wikidata: Q6460421
• Pharos Ligand ID: 3P7XXGJCDVXW
• ChEMBL ID: CHEMBL411481
• Mol file: 176977-56-3.mol

Synonyms:4-((6-methoxy-2-(4-methoxyphenyl)-1-benzofuran-3-yl)carbonyl)benzonitrile;LY 320135;LY-320135;LY320135

Chemical Property of 4-(6-Methoxy-2-(4-methoxyphenyl)benzofuran-3-carbonyl)benzonitrile

Chemical Property:

• Vapor Pressure: 3.64E-15mmHg at 25°C
• Refractive Index: 1.664
• Boiling Point: 617.234 °C at 760 mmHg
• Flash Point: 327.092 °C
• PSA: 72.46000
• Density: 1.314 g/cm³
• LogP: 5.21968
• Storage Temp.: Store at RT
• Solubility.: DMSO: ≥10mg/mL
• XLogP3: 5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 383.11575802
• Heavy Atom Count: 29
• Complexity: 612

Purity/Quality:

98%,99%, ^*data from raw suppliers

LY 320135 ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 25
• Safety Statements: 45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C2=C(C3=C(O2)C=C(C=C3)OC)C(=O)C4=CC=C(C=C4)C#N
• Uses: [6-Methoxy-2-(4-methoxyphenyl)benzo[b]furan-3-yl](4-cyanophenyl)methanone is a selective antagonist for the brain CB1 receptor, having greater than 70-fold higher affinity for the CB1 than the periphe ral CB2 receptor. [6-Methoxy-2-(4-methoxyphenyl)benzo[b]furan-3-yl](4-cyanophenyl)methanone is a promising lead compound for the further development of selective cannabinoid antagonists of novel struc ture.

Technology Process of 4-(6-Methoxy-2-(4-methoxyphenyl)benzofuran-3-carbonyl)benzonitrile

There total 1 articles about 4-(6-Methoxy-2-(4-methoxyphenyl)benzofuran-3-carbonyl)benzonitrile 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:

2-(4-'methoxyphenyl)-6-methoxybenzo[b]furan (1838-44-4) + 4-cyanobenzoyl chlorIde (6068-72-0) → 4-[6-methoxy-2-(4-methoxyphenyl)-1-benzofuran-3-carbonyl]benzonitrile (176977-56-3)

Guidance literature:

With sodium hydrogencarbonate; TiCl₄; In dichloromethane;

upstream raw materials:

2-(4-'methoxyphenyl)-6-methoxybenzo[b]furan

4-cyanobenzoyl chlorIde

Refernces