methyl N'-((rac)-3-exo-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-N-(3-(3,4-difluorophenyl)-5-methylpyridin-2-yl)carbamimidothioate

Base Information

• Chemical Name: methyl N'-((rac)-3-exo-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-N-(3-(3,4-difluorophenyl)-5-methylpyridin-2-yl)carbamimidothioate
• CAS No.: 1397287-26-1
• Molecular Formula: C₂₈H₃₀F₂N₄S
• Molecular Weight: 492.636
• Mol file: 1397287-26-1.mol

Synonyms:methyl N'-((rac)-3-exo-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-N-(3-(3,4-difluorophenyl)-5-methylpyridin-2-yl)carbamimidothioate

Chemical Property of methyl N'-((rac)-3-exo-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-N-(3-(3,4-difluorophenyl)-5-methylpyridin-2-yl)carbamimidothioate

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of methyl N'-((rac)-3-exo-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-N-(3-(3,4-difluorophenyl)-5-methylpyridin-2-yl)carbamimidothioate

There total 5 articles about methyl N'-((rac)-3-exo-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-N-(3-(3,4-difluorophenyl)-5-methylpyridin-2-yl)carbamimidothioate 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: 94.0%

1-((rac)-3-exo-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-3-(3-(3,4-difluorophenyl)-5-methylpyridin-2-yl)thiourea (1397287-25-0) + methyl iodide (74-88-4) → methyl N'-((rac)-3-exo-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-N-(3-(3,4-difluorophenyl)-5-methylpyridin-2-yl)carbamimidothioate (1397287-26-1)

Guidance literature:

In ISOPROPYLAMIDE; at 80 ℃; for 2h;

Reference yield:

(3,4-difluorophenyl)boronic acid (168267-41-2) → methyl N'-((rac)-3-exo-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-N-(3-(3,4-difluorophenyl)-5-methylpyridin-2-yl)carbamimidothioate (1397287-26-1)

Guidance literature:

Multi-step reaction with 4 steps

1: sodium carbonate / dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH₂Cl₂ / 1,4-dioxane; water / 1 h / 100 °C / Inert atmosphere

2: sodium carbonate / dichloromethane; water / 0.25 h

3: ISOPROPYLAMIDE / 0.25 h / 50 °C

4: ISOPROPYLAMIDE / 2 h / 80 °C

With sodium carbonate; dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH₂Cl₂; In 1,4-dioxane; dichloromethane; ISOPROPYLAMIDE; water; 1: Suzuki Coupling;

Reference yield:

3-bromo-5-methylpyridin-2-amine (17282-00-7) → methyl N'-((rac)-3-exo-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-N-(3-(3,4-difluorophenyl)-5-methylpyridin-2-yl)carbamimidothioate (1397287-26-1)

Guidance literature:

Multi-step reaction with 4 steps

1: sodium carbonate / dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH₂Cl₂ / 1,4-dioxane; water / 1 h / 100 °C / Inert atmosphere

2: sodium carbonate / dichloromethane; water / 0.25 h

3: ISOPROPYLAMIDE / 0.25 h / 50 °C

4: ISOPROPYLAMIDE / 2 h / 80 °C

With sodium carbonate; dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH₂Cl₂; In 1,4-dioxane; dichloromethane; ISOPROPYLAMIDE; water; 1: Suzuki Coupling;

upstream raw materials:

(3,4-difluorophenyl)boronic acid

1-((rac)-3-exo-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-3-(3-(3,4-difluorophenyl)-5-methylpyridin-2-yl)thiourea

methyl iodide

3-bromo-5-methylpyridin-2-amine

Downstream raw materials:

((rac)-3-exo-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-8-(3,4-difluorophenyl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine

((rac)-3-exo-8-(2-chloropyridin-4-yl)-8-azabicyclo[3.2.1]octan-3-yl)-8-(3,4-difluorophenyl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine