4-({[5-(9-{[(2R)-2-hydroxy-2-(8-hydroxy-2-oxo-1,2-dihydroquinolin-5-yl)ethyl]amino}nonyl)-2-phenylphenyl]carbamoyl}oxy)-1,1-dimethylpiperidin-1-ium trifluoroacetate

Base Information

• Chemical Name: 4-({[5-(9-{[(2R)-2-hydroxy-2-(8-hydroxy-2-oxo-1,2-dihydroquinolin-5-yl)ethyl]amino}nonyl)-2-phenylphenyl]carbamoyl}oxy)-1,1-dimethylpiperidin-1-ium trifluoroacetate
• CAS No.: 1254099-09-6
• Molecular Formula: C₂F₃O₂*C₄₀H₅₃N₄O₅
• Molecular Weight: 782.901
• Mol file: 1254099-09-6.mol

Synonyms:4-({[5-(9-{[(2R)-2-hydroxy-2-(8-hydroxy-2-oxo-1,2-dihydroquinolin-5-yl)ethyl]amino}nonyl)-2-phenylphenyl]carbamoyl}oxy)-1,1-dimethylpiperidin-1-ium trifluoroacetate

Chemical Property of 4-({[5-(9-{[(2R)-2-hydroxy-2-(8-hydroxy-2-oxo-1,2-dihydroquinolin-5-yl)ethyl]amino}nonyl)-2-phenylphenyl]carbamoyl}oxy)-1,1-dimethylpiperidin-1-ium trifluoroacetate

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 4-({[5-(9-{[(2R)-2-hydroxy-2-(8-hydroxy-2-oxo-1,2-dihydroquinolin-5-yl)ethyl]amino}nonyl)-2-phenylphenyl]carbamoyl}oxy)-1,1-dimethylpiperidin-1-ium trifluoroacetate

There total 9 articles about 4-({[5-(9-{[(2R)-2-hydroxy-2-(8-hydroxy-2-oxo-1,2-dihydroquinolin-5-yl)ethyl]amino}nonyl)-2-phenylphenyl]carbamoyl}oxy)-1,1-dimethylpiperidin-1-ium trifluoroacetate 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-({[5-(9-[{(2R)-[8-(benzyloxy)-2-oxo-1,2-dihydroquinolin-5-yl]-2-hydroxyethyl}amino]nonyl)-2-phenylphenyl]carbamoyl}oxy)-1,1-dimethylpiperidin-1-ium trifluoroacetate (1254103-10-0) → 4-({[5-(9-{[(2R)-2-hydroxy-2-(8-hydroxy-2-oxo-1,2-dihydroquinolin-5-yl)ethyl]amino}nonyl)-2-phenylphenyl]carbamoyl}oxy)-1,1-dimethylpiperidin-1-ium trifluoroacetate (1254099-09-6)

Guidance literature:

With hydrogen; palladium 10% on activated carbon; In methanol; at 20 ℃; for 2h;

Reference yield:

8-Hydroxyquinoline-N-oxide (1127-45-3) → 4-({[5-(9-{[(2R)-2-hydroxy-2-(8-hydroxy-2-oxo-1,2-dihydroquinolin-5-yl)ethyl]amino}nonyl)-2-phenylphenyl]carbamoyl}oxy)-1,1-dimethylpiperidin-1-ium trifluoroacetate (1254099-09-6)

Guidance literature:

Multi-step reaction with 7 steps

1.1: 2.5 h / 70 °C / Cooling with ice

2.1: aluminum (III) chloride / 1,1-dichloroethane / 3 h / 80 °C / Cooling with ice

2.2: 20 °C

3.1: potassium carbonate / N,N-dimethyl-formamide / 2 h / 20 °C

4.1: pyridinium hydrobromide perbromide / tetrahydrofuran / 0 °C / Reflux

5.1: (3aR)-1-methyl-3,3-diphenyl-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole / tetrahydrofuran / 0.67 h / -55 - -45 °C / Inert atmosphere

5.2: -45 - 0 °C / Inert atmosphere

5.3: 20 °C

6.1: hydrogen bromide / methanol / 3 h / 80 °C

6.2: 100 °C

7.1: hydrogen / palladium 10% on activated carbon / methanol / 2 h / 20 °C

With aluminum (III) chloride; pyridinium hydrobromide perbromide; hydrogen bromide; hydrogen; potassium carbonate; palladium 10% on activated carbon; (3aR)-1-methyl-3,3-diphenyl-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole; In tetrahydrofuran; methanol; 1,1-dichloroethane; N,N-dimethyl-formamide;

Reference yield:

8-quinolinol (148-24-3,24804-14-6) → 4-({[5-(9-{[(2R)-2-hydroxy-2-(8-hydroxy-2-oxo-1,2-dihydroquinolin-5-yl)ethyl]amino}nonyl)-2-phenylphenyl]carbamoyl}oxy)-1,1-dimethylpiperidin-1-ium trifluoroacetate (1254099-09-6)

Guidance literature:

Multi-step reaction with 8 steps

1.1: 3-chloro-benzenecarboperoxoic acid / dichloromethane / 2 h / 20 °C / Cooling with ice

2.1: 2.5 h / 70 °C / Cooling with ice

3.1: aluminum (III) chloride / 1,1-dichloroethane / 3 h / 80 °C / Cooling with ice

3.2: 20 °C

4.1: potassium carbonate / N,N-dimethyl-formamide / 2 h / 20 °C

5.1: pyridinium hydrobromide perbromide / tetrahydrofuran / 0 °C / Reflux

6.1: (3aR)-1-methyl-3,3-diphenyl-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole / tetrahydrofuran / 0.67 h / -55 - -45 °C / Inert atmosphere

6.2: -45 - 0 °C / Inert atmosphere

6.3: 20 °C

7.1: hydrogen bromide / methanol / 3 h / 80 °C

7.2: 100 °C

8.1: hydrogen / palladium 10% on activated carbon / methanol / 2 h / 20 °C

With aluminum (III) chloride; pyridinium hydrobromide perbromide; hydrogen bromide; hydrogen; potassium carbonate; 3-chloro-benzenecarboperoxoic acid; palladium 10% on activated carbon; (3aR)-1-methyl-3,3-diphenyl-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole; In tetrahydrofuran; methanol; 1,1-dichloroethane; dichloromethane; N,N-dimethyl-formamide;

upstream raw materials:

8-Hydroxyquinoline-N-oxide

8-quinolinol

2-oxo-1,2-dihydroquinolin-8-yl acetate

8-(benzyloxy)-5-[(1R)-2-bromo-1-hydroxyethyl]quinolin-2(1H)-one

Refernces