3-[3-(4-amino-2-oxo-2H-pyrimidin-1-ylmethyl)-6-bromo-2-fluoro-phenoxy]-5-chloro-benzonitrile

Base Information

Chemical Name:3-[3-(4-amino-2-oxo-2H-pyrimidin-1-ylmethyl)-6-bromo-2-fluoro-phenoxy]-5-chloro-benzonitrile
CAS No.:1089178-54-0
Molecular Formula:C₁₈H₁₁BrClFN₄O₂
Molecular Weight:449.666
Hs Code.:

Synonyms:3-[3-(4-amino-2-oxo-2H-pyrimidin-1-ylmethyl)-6-bromo-2-fluoro-phenoxy]-5-chloro-benzonitrile

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Chemical Property of 3-[3-(4-amino-2-oxo-2H-pyrimidin-1-ylmethyl)-6-bromo-2-fluoro-phenoxy]-5-chloro-benzonitrile

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Technology Process of 3-[3-(4-amino-2-oxo-2H-pyrimidin-1-ylmethyl)-6-bromo-2-fluoro-phenoxy]-5-chloro-benzonitrile

There total 6 articles about 3-[3-(4-amino-2-oxo-2H-pyrimidin-1-ylmethyl)-6-bromo-2-fluoro-phenoxy]-5-chloro-benzonitrile 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: 67.0%

: 1007571-61-0
3-(6-bromo-3-(bromomethyl)-2-fluorophenoxy)-5-chlorobenzonitrile

: 71-30-7
Cytosine

: 1089178-54-0
3-[3-(4-amino-2-oxo-2H-pyrimidin-1-ylmethyl)-6-bromo-2-fluoro-phenoxy]-5-chloro-benzonitrile

Guidance literature:: Cytosine; With chloro-trimethyl-silane; 1,1,1,3,3,3-hexamethyl-disilazane; at 120 ℃; for 1h;

3-(6-bromo-3-(bromomethyl)-2-fluorophenoxy)-5-chlorobenzonitrile; iodine; at 80 ℃; for 18h;

Reference yield:

: 473923-97-6
3-chloro-5-hydroxybenzonitrile

: 1089178-54-0
3-[3-(4-amino-2-oxo-2H-pyrimidin-1-ylmethyl)-6-bromo-2-fluoro-phenoxy]-5-chloro-benzonitrile

Guidance literature:: Multi-step reaction with 5 steps

1.1: sodium hydride / ISOPROPYLAMIDE / 0.5 h / 50 °C

1.2: 2 h / 125 °C

2.1: isopropylmagnesium chloride / tetrahydrofuran; toluene / 1 h / -78 °C

2.2: 2 h / -50 °C

2.3: -78 - 20 °C

3.1: sodium tetrahydroborate / tetrahydrofuran; methanol / 24 h / 20 °C

4.1: phosphorus tribromide / dichloromethane / 24 h / 20 °C

5.1: chloro-trimethyl-silane; 1,1,1,3,3,3-hexamethyl-disilazane / 1 h / 120 °C

5.2: 18 h / 80 °C

With sodium tetrahydroborate; chloro-trimethyl-silane; isopropylmagnesium chloride; phosphorus tribromide; sodium hydride; 1,1,1,3,3,3-hexamethyl-disilazane; In tetrahydrofuran; methanol; dichloromethane; ISOPROPYLAMIDE; toluene;

Reference yield:

: 473923-96-5
3-chloro-5-methoxybenzonitrile

: 1089178-54-0
3-[3-(4-amino-2-oxo-2H-pyrimidin-1-ylmethyl)-6-bromo-2-fluoro-phenoxy]-5-chloro-benzonitrile

Guidance literature:: Multi-step reaction with 6 steps

1.1: 2,4,6-trimethyl-pyridine; lithium iodide / 4 h / 170 °C

1.2: 20 °C

2.1: sodium hydride / ISOPROPYLAMIDE / 0.5 h / 50 °C

2.2: 2 h / 125 °C

3.1: isopropylmagnesium chloride / tetrahydrofuran; toluene / 1 h / -78 °C

3.2: 2 h / -50 °C

3.3: -78 - 20 °C

4.1: sodium tetrahydroborate / tetrahydrofuran; methanol / 24 h / 20 °C

5.1: phosphorus tribromide / dichloromethane / 24 h / 20 °C

6.1: chloro-trimethyl-silane; 1,1,1,3,3,3-hexamethyl-disilazane / 1 h / 120 °C

6.2: 18 h / 80 °C

With 2,4,6-trimethyl-pyridine; sodium tetrahydroborate; chloro-trimethyl-silane; isopropylmagnesium chloride; phosphorus tribromide; sodium hydride; 1,1,1,3,3,3-hexamethyl-disilazane; lithium iodide; In tetrahydrofuran; methanol; dichloromethane; ISOPROPYLAMIDE; toluene;