5-{3-[3-(2,3-dihydroxypropyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-6-yl]-1,2,4-oxadiazol-5-yl}-2-[(1-methylethyl)oxy]benzonitrile monohydrochloride

Base Information

Chemical Name:5-{3-[3-(2,3-dihydroxypropyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-6-yl]-1,2,4-oxadiazol-5-yl}-2-[(1-methylethyl)oxy]benzonitrile monohydrochloride
CAS No.:1258852-39-9
Molecular Formula:C₂₅H₂₈N₄O₄*ClH
Molecular Weight:484.983
Hs Code.:

Synonyms:5-{3-[3-(2,3-dihydroxypropyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-6-yl]-1,2,4-oxadiazol-5-yl}-2-[(1-methylethyl)oxy]benzonitrile monohydrochloride

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Chemical Property of 5-{3-[3-(2,3-dihydroxypropyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-6-yl]-1,2,4-oxadiazol-5-yl}-2-[(1-methylethyl)oxy]benzonitrile monohydrochloride

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Technology Process of 5-{3-[3-(2,3-dihydroxypropyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-6-yl]-1,2,4-oxadiazol-5-yl}-2-[(1-methylethyl)oxy]benzonitrile monohydrochloride

There total 8 articles about 5-{3-[3-(2,3-dihydroxypropyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-6-yl]-1,2,4-oxadiazol-5-yl}-2-[(1-methylethyl)oxy]benzonitrile monohydrochloride 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: 47.0%

: 1258855-43-4
2-[(1-methylethyl)oxy]-5-[3-(2,3,4,5-tetrahydro-1H-3-benzazepin-6-yl)-1,2,4-oxadiazol-5-yl]benzonitrile mono-trifluoroacetic acid salt

: 56-82-6,367-47-5,26793-98-6
Glyceraldehyde

: 1258852-39-9
5-{3-[3-(2,3-dihydroxypropyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-6-yl]-1,2,4-oxadiazol-5-yl}-2-[(1-methylethyl)oxy]benzonitrile monohydrochloride

Guidance literature:: 2-[(1-methylethyl)oxy]-5-[3-(2,3,4,5-tetrahydro-1H-3-benzazepin-6-yl)-1,2,4-oxadiazol-5-yl]benzonitrile mono-trifluoroacetic acid salt; Glyceraldehyde; In dichloromethane; at 20 ℃;

With sodium tris(acetoxy)borohydride; In dichloromethane; for 5h;

Glyceraldehyde;

Reference yield:

: 258273-31-3
3-cyano-4-isopropoxybenzoic acid

: 1258852-39-9
5-{3-[3-(2,3-dihydroxypropyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-6-yl]-1,2,4-oxadiazol-5-yl}-2-[(1-methylethyl)oxy]benzonitrile monohydrochloride

Guidance literature:: Multi-step reaction with 4 steps

1.1: oxalyl dichloride / N,N-dimethyl-formamide / 4 h / 20 °C

2.1: triethylamine / N,N-dimethyl-formamide / 3.5 h / 20 - 120 °C / Inert atmosphere

3.1: dichloromethane / 0 - 20 °C

4.1: dichloromethane / 20 °C

4.2: 5 h

With oxalyl dichloride; triethylamine; N,N-dimethyl-formamide; In dichloromethane; N,N-dimethyl-formamide;

Reference yield:

: 1072948-37-8
3-cyano-4-[(1-methylethyl)oxy]benzoyl chloride

: 1258852-39-9
5-{3-[3-(2,3-dihydroxypropyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-6-yl]-1,2,4-oxadiazol-5-yl}-2-[(1-methylethyl)oxy]benzonitrile monohydrochloride

Guidance literature:: Multi-step reaction with 3 steps

1.1: triethylamine / N,N-dimethyl-formamide / 3.5 h / 20 - 120 °C / Inert atmosphere

2.1: dichloromethane / 0 - 20 °C

3.1: dichloromethane / 20 °C

3.2: 5 h

With triethylamine; In dichloromethane; N,N-dimethyl-formamide;