2-[({3-(4-Chlorophenyl)-5-oxo-4-[(2S)-3,3,3-trifluoro-2-hydroxypropyl]-4,5-dihydro-1H-1,2,4-triazol-1-yl}acetyl)amino]-3,3,3-trifluoro-2-[3-(trifluoromethyl)phenyl]propanamide

Base Information

Chemical Name:2-[({3-(4-Chlorophenyl)-5-oxo-4-[(2S)-3,3,3-trifluoro-2-hydroxypropyl]-4,5-dihydro-1H-1,2,4-triazol-1-yl}acetyl)amino]-3,3,3-trifluoro-2-[3-(trifluoromethyl)phenyl]propanamide
CAS No.:1245940-94-6
Molecular Formula:C₂₃H₁₇ClF₉N₅O₄
Molecular Weight:633.858
Hs Code.:

2-[({3-(4-Chlorophenyl)-5-oxo-4-[(2S)-3,3,3-trifluoro-2-hydroxypropyl]-4,5-dihydro-1H-1,2,4-triazol-1-yl}acetyl)amino]-3,3,3-trifluoro-2-[3-(trifluoromethyl)phenyl]propanamide

Synonyms:2-[({3-(4-Chlorophenyl)-5-oxo-4-[(2S)-3,3,3-trifluoro-2-hydroxypropyl]-4,5-dihydro-1H-1,2,4-triazol-1-yl}acetyl)amino]-3,3,3-trifluoro-2-[3-(trifluoromethyl)phenyl]propanamide

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Chemical Property of 2-[({3-(4-Chlorophenyl)-5-oxo-4-[(2S)-3,3,3-trifluoro-2-hydroxypropyl]-4,5-dihydro-1H-1,2,4-triazol-1-yl}acetyl)amino]-3,3,3-trifluoro-2-[3-(trifluoromethyl)phenyl]propanamide

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Technology Process of 2-[({3-(4-Chlorophenyl)-5-oxo-4-[(2S)-3,3,3-trifluoro-2-hydroxypropyl]-4,5-dihydro-1H-1,2,4-triazol-1-yl}acetyl)amino]-3,3,3-trifluoro-2-[3-(trifluoromethyl)phenyl]propanamide

There total 9 articles about 2-[({3-(4-Chlorophenyl)-5-oxo-4-[(2S)-3,3,3-trifluoro-2-hydroxypropyl]-4,5-dihydro-1H-1,2,4-triazol-1-yl}acetyl)amino]-3,3,3-trifluoro-2-[3-(trifluoromethyl)phenyl]propanamide 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: 53.0%

: 2-Amino-3,3,3-trifluoro-2-[3-(trifluoromethyl)phenyl]propanoic acid

: 1245940-68-4
{4-[(2S)-2-{[tert-Butyl(dimethyl)silyl]oxy}-3,3,3-trifluoropropyl]-3-(4-chlorophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl}acetic acid

: 1245940-94-6
2-[({3-(4-Chlorophenyl)-5-oxo-4-[(2S)-3,3,3-trifluoro-2-hydroxypropyl]-4,5-dihydro-1H-1,2,4-triazol-1-yl}acetyl)amino]-3,3,3-trifluoro-2-[3-(trifluoromethyl)phenyl]propanamide

Guidance literature:: {4-[(2S)-2-{[tert-Butyl(dimethyl)silyl]oxy}-3,3,3-trifluoropropyl]-3-(4-chlorophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl}acetic acid; With 1-chloro-1-(dimethylamino)-2-methyl-1-propene; In dichloromethane; at 20 ℃; for 0.166667h;

2-Amino-3,3,3-trifluoro-2-[3-(trifluoromethyl)phenyl]propanoic acid; pyridine; In dichloromethane;

With tetrabutyl ammonium fluoride; In dichloromethane; at 20 ℃; for 1.25h;

Reference yield:

: 721-37-9
2,2,2-trifluoro-3'-(trifluoromethyl)acetophenone

: 1245940-94-6
2-[({3-(4-Chlorophenyl)-5-oxo-4-[(2S)-3,3,3-trifluoro-2-hydroxypropyl]-4,5-dihydro-1H-1,2,4-triazol-1-yl}acetyl)amino]-3,3,3-trifluoro-2-[3-(trifluoromethyl)phenyl]propanamide

Guidance literature:: Multi-step reaction with 2 steps

1.1: (R)-2-methylpropane-2-sulfinamide / titanium(IV) isopropylate / hexane / 20 °C

1.2: 72 h / 20 °C

2.1: 1-chloro-1-(dimethylamino)-2-methyl-1-propene / dichloromethane / 0.17 h / 20 °C

2.3: 1.25 h / 20 °C

With 1-chloro-1-(dimethylamino)-2-methyl-1-propene; (R)-2-methylpropane-2-sulfinamide; titanium(IV) isopropylate; In hexane; dichloromethane;

Reference yield:

: 1228650-22-3
[3-(4-chlorophenyl)-5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]acetic acid

: 1245940-94-6
2-[({3-(4-Chlorophenyl)-5-oxo-4-[(2S)-3,3,3-trifluoro-2-hydroxypropyl]-4,5-dihydro-1H-1,2,4-triazol-1-yl}acetyl)amino]-3,3,3-trifluoro-2-[3-(trifluoromethyl)phenyl]propanamide

Guidance literature:: Multi-step reaction with 7 steps

1.1: pyridine / 0.5 h / 35 °C / Inert atmosphere

1.2: 70 °C

2.1: sodium tetrahydroborate / methanol / 1.5 h / Cooling with ice

3.1: potassium carbonate; potassium iodide / acetonitrile / 1 h / Reflux

4.1: ethyl acetate; 2-Methylpentane / Resolution of racemate

5.1: lithium hydroxide / water; methanol / 1 h / 20 °C

5.2: pH 1 - 2

6.1: 1H-imidazole / N,N-dimethyl-formamide / 20 °C

6.2: 0.5 h

6.3: pH 4

7.1: 1-chloro-1-(dimethylamino)-2-methyl-1-propene / dichloromethane / 0.17 h / 20 °C

7.3: 1.25 h / 20 °C

With 1H-imidazole; sodium tetrahydroborate; 1-chloro-1-(dimethylamino)-2-methyl-1-propene; potassium carbonate; potassium iodide; lithium hydroxide; In pyridine; methanol; 2-Methylpentane; dichloromethane; water; ethyl acetate; N,N-dimethyl-formamide; acetonitrile;