vx984

Base Information

• Chemical Name: vx984
• CAS No.: 1476074-39-1
• Molecular Formula: C₂₃H₂₃N₇O
• Molecular Weight: 415.466
• Mol file: 1476074-39-1.mol

Synonyms:

Chemical Property of vx984

Chemical Property:

Purity/Quality:

99% ^*data from raw suppliers

VX-984 99.36% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of vx984

There total 14 articles about vx984 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: 28.0%

(S)-8-(1-((6-chloropyrimidin-4-yl)amino)propan-2-yl)-N-methylquinoline-4-carboxamide (1476076-42-2) + 2-methyl-4,6-dideutero-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine (1476076-45-5) → (S)-N-methyl-8-(1-((2'-methyl-4',6'-dideutero-[4,5'-bipyrimidin]-6-yl)amino)propan-2-yl)quinoline-4-carboxamide (1476074-39-1)

Guidance literature:

With sodium carbonate; In 1,4-dioxane; water; at 90 ℃; for 16h; Inert atmosphere;

Reference yield:

8-bromo-4-methylquinoline (172939-50-3) → (S)-N-methyl-8-(1-((2'-methyl-4',6'-dideutero-[4,5'-bipyrimidin]-6-yl)amino)propan-2-yl)quinoline-4-carboxamide (1476074-39-1)

Guidance literature:

Multi-step reaction with 10 steps

1.1: selenium(IV) oxide / 1,4-dioxane; water / 0.5 h / 77 °C / Reflux

2.1: sodium chlorite; sodium phosphate / tetrahydrofuran; water / 2 h / 5 - 10 °C

2.2: 20 °C

3.1: N,N-dimethyl-formamide; oxalyl dichloride / dichloromethane / 1 h / 10 °C

4.1: tetrahydrofuran; water / 16 h / 5 - 20 °C

5.1: sodium carbonate; dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH₂Cl₂ / 1,4-dioxane; water / 16 h / Inert atmosphere; Reflux

6.1: hydrogenchloride / isopropyl alcohol; ethanol / 2 h / 60 °C

6.2: 12 h / 0 - 20 °C

7.1: (-)-1,2-bis-((2R,5R)-2,5-diethylphospholano)benzene(cyclooctadiene) rhodium(I) trifluoromethanesulfonate / methanol / 14 h / 35 - 50 °C / 5171.62 Torr / Inert atmosphere

8.1: hydrogenchloride / water / 96 h / 60 - 70 °C

9.1: sodium carbonate / tetrahydrofuran; water / 2 h / 66 °C

10.1: sodium carbonate / 1,4-dioxane; water / 16 h / 90 °C / Inert atmosphere

With hydrogenchloride; selenium(IV) oxide; sodium chlorite; dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH₂Cl₂; oxalyl dichloride; (-)-1,2-bis-((2R,5R)-2,5-diethylphospholano)benzene(cyclooctadiene) rhodium(I) trifluoromethanesulfonate; sodium carbonate; N,N-dimethyl-formamide; sodium phosphate; In tetrahydrofuran; 1,4-dioxane; methanol; ethanol; dichloromethane; water; isopropyl alcohol;

Reference yield:

8-bromo-quinoline-4-carbaldehyde (898391-87-2) → (S)-N-methyl-8-(1-((2'-methyl-4',6'-dideutero-[4,5'-bipyrimidin]-6-yl)amino)propan-2-yl)quinoline-4-carboxamide (1476074-39-1)

Guidance literature:

Multi-step reaction with 9 steps

1.1: sodium chlorite; sodium phosphate / tetrahydrofuran; water / 2 h / 5 - 10 °C

1.2: 20 °C

2.1: N,N-dimethyl-formamide; oxalyl dichloride / dichloromethane / 1 h / 10 °C

3.1: tetrahydrofuran; water / 16 h / 5 - 20 °C

4.1: sodium carbonate; dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH₂Cl₂ / 1,4-dioxane; water / 16 h / Inert atmosphere; Reflux

5.1: hydrogenchloride / isopropyl alcohol; ethanol / 2 h / 60 °C

5.2: 12 h / 0 - 20 °C

6.1: (-)-1,2-bis-((2R,5R)-2,5-diethylphospholano)benzene(cyclooctadiene) rhodium(I) trifluoromethanesulfonate / methanol / 14 h / 35 - 50 °C / 5171.62 Torr / Inert atmosphere

7.1: hydrogenchloride / water / 96 h / 60 - 70 °C

8.1: sodium carbonate / tetrahydrofuran; water / 2 h / 66 °C

9.1: sodium carbonate / 1,4-dioxane; water / 16 h / 90 °C / Inert atmosphere

With hydrogenchloride; sodium chlorite; dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH₂Cl₂; oxalyl dichloride; (-)-1,2-bis-((2R,5R)-2,5-diethylphospholano)benzene(cyclooctadiene) rhodium(I) trifluoromethanesulfonate; sodium carbonate; N,N-dimethyl-formamide; sodium phosphate; In tetrahydrofuran; 1,4-dioxane; methanol; ethanol; dichloromethane; water; isopropyl alcohol;

upstream raw materials:

8-bromo-4-methylquinoline

8-bromo-quinoline-4-carbaldehyde

8-bromoquinoline-4-carboxylic acid

8-bromo-N-methyl-quinoline-4-carboxamide

Refernces

• 1、 -. "DNA-PK INHIBITORS". . . Retrieved 2013/11/05.