18-(2,4-difluorophenyl)-13-methyl-7-(3-methyl-1H-1,2,4-triazol-1-yl)-10,11,12,13,14,16,17,18-octahydro-3H-15,2-(azeno)-4,8-(metheno)cyciopenta[h][1,6,10,12]oxatriazacycloheptadecine

Base Information

• Chemical Name: 18-(2,4-difluorophenyl)-13-methyl-7-(3-methyl-1H-1,2,4-triazol-1-yl)-10,11,12,13,14,16,17,18-octahydro-3H-15,2-(azeno)-4,8-(metheno)cyciopenta[h][1,6,10,12]oxatriazacycloheptadecine
• CAS No.: 1356008-77-9
• Molecular Formula: C₂₇H₂₇F₂N₇O
• Molecular Weight: 503.554
• Mol file: 1356008-77-9.mol

Synonyms:18-(2,4-difluorophenyl)-13-methyl-7-(3-methyl-1H-1,2,4-triazol-1-yl)-10,11,12,13,14,16,17,18-octahydro-3H-15,2-(azeno)-4,8-(metheno)cyciopenta[h][1,6,10,12]oxatriazacycloheptadecine

Chemical Property of 18-(2,4-difluorophenyl)-13-methyl-7-(3-methyl-1H-1,2,4-triazol-1-yl)-10,11,12,13,14,16,17,18-octahydro-3H-15,2-(azeno)-4,8-(metheno)cyciopenta[h][1,6,10,12]oxatriazacycloheptadecine

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 18-(2,4-difluorophenyl)-13-methyl-7-(3-methyl-1H-1,2,4-triazol-1-yl)-10,11,12,13,14,16,17,18-octahydro-3H-15,2-(azeno)-4,8-(metheno)cyciopenta[h][1,6,10,12]oxatriazacycloheptadecine

There total 14 articles about 18-(2,4-difluorophenyl)-13-methyl-7-(3-methyl-1H-1,2,4-triazol-1-yl)-10,11,12,13,14,16,17,18-octahydro-3H-15,2-(azeno)-4,8-(metheno)cyciopenta[h][1,6,10,12]oxatriazacycloheptadecine 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:

N-(5-(5-amino-2-(3-methyl-1H-1,2,4-triazol-1-yl)phenoxy)pentan-2-yl)-2-chloro-7-(2,4-difluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (1356010-60-0) → 18-(2,4-difluorophenyl)-13-methyl-7-(3-methyl-1H-1,2,4-triazol-1-yl)-10,11,12,13,14,16,17,18-octahydro-3H-15,2-(azeno)-4,8-(metheno)cyciopenta[h][1,6,10,12]oxatriazacycloheptadecine (1356008-77-9)

Guidance literature:

With caesium carbonate; palladium diacetate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; In 1,4-dioxane; at 110 ℃; for 4h; Inert atmosphere;

Reference yield:

tert-butyl (4-hydroxy-1-methylbutyl)carbamate (179412-96-5) → 18-(2,4-difluorophenyl)-13-methyl-7-(3-methyl-1H-1,2,4-triazol-1-yl)-10,11,12,13,14,16,17,18-octahydro-3H-15,2-(azeno)-4,8-(metheno)cyciopenta[h][1,6,10,12]oxatriazacycloheptadecine (1356008-77-9)

Guidance literature:

Multi-step reaction with 6 steps

1: carbon tetrabromide; triphenylphosphine / dichloromethane / 18 h / 20 °C / Cooling with ice

2: caesium carbonate / N,N-dimethyl-formamide / 18 h / 20 °C

3: trifluoroacetic acid / dichloromethane / 1 h / 20 °C

4: N-ethyl-N,N-diisopropylamine / acetonitrile / 18 h / 20 °C

5: ammonium chloride; iron / water; tetrahydrofuran; methanol / 2 h / 70 °C

6: caesium carbonate / palladium diacetate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene / 1,4-dioxane / 4 h / 110 °C / Inert atmosphere

With carbon tetrabromide; iron; ammonium chloride; caesium carbonate; N-ethyl-N,N-diisopropylamine; triphenylphosphine; trifluoroacetic acid; palladium diacetate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; In tetrahydrofuran; 1,4-dioxane; methanol; dichloromethane; water; N,N-dimethyl-formamide; acetonitrile;

Reference yield:

2-chloro-5-nitroanisole (1009-36-5) → 18-(2,4-difluorophenyl)-13-methyl-7-(3-methyl-1H-1,2,4-triazol-1-yl)-10,11,12,13,14,16,17,18-octahydro-3H-15,2-(azeno)-4,8-(metheno)cyciopenta[h][1,6,10,12]oxatriazacycloheptadecine (1356008-77-9)

Guidance literature:

Multi-step reaction with 9 steps

1: boron tribromide / dichloromethane / -78 - 4 °C / Inert atmosphere

2: potassium carbonate / acetonitrile / 18 h / 20 °C

3: potassium hydroxide / dimethyl sulfoxide / 18 h / 95 °C

4: trifluoroacetic acid / dichloromethane / 1 h / 20 °C

5: caesium carbonate / N,N-dimethyl-formamide / 18 h / 20 °C

6: trifluoroacetic acid / dichloromethane / 1 h / 20 °C

7: N-ethyl-N,N-diisopropylamine / acetonitrile / 18 h / 20 °C

8: ammonium chloride; iron / water; tetrahydrofuran; methanol / 2 h / 70 °C

9: caesium carbonate / palladium diacetate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene / 1,4-dioxane / 4 h / 110 °C / Inert atmosphere

With boron tribromide; iron; potassium carbonate; ammonium chloride; caesium carbonate; N-ethyl-N,N-diisopropylamine; trifluoroacetic acid; potassium hydroxide; palladium diacetate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; In tetrahydrofuran; 1,4-dioxane; methanol; dichloromethane; water; dimethyl sulfoxide; N,N-dimethyl-formamide; acetonitrile;

upstream raw materials:

tert-butyl (4-hydroxy-1-methylbutyl)carbamate

2-chloro-5-nitroanisole

(±)-4-amino-1-pentanol

5-nitro-2-chlorophenol

Refernces