3-(3-chlorophenyl)-3-(2-amino-4-oxo-3H,5H-pyrrolo<3,2-d>pyrimidin-7-yl)propanenitrile

Base Information

Chemical Name:3-(3-chlorophenyl)-3-(2-amino-4-oxo-3H,5H-pyrrolo<3,2-d>pyrimidin-7-yl)propanenitrile
CAS No.:139367-69-4
Molecular Formula:C₁₅H₁₂ClN₅O
Molecular Weight:313.746
Hs Code.:

Synonyms:3-(3-chlorophenyl)-3-(2-amino-4-oxo-3H,5H-pyrrolo<3,2-d>pyrimidin-7-yl)propanenitrile

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Chemical Property of 3-(3-chlorophenyl)-3-(2-amino-4-oxo-3H,5H-pyrrolo<3,2-d>pyrimidin-7-yl)propanenitrile

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Technology Process of 3-(3-chlorophenyl)-3-(2-amino-4-oxo-3H,5H-pyrrolo<3,2-d>pyrimidin-7-yl)propanenitrile

There total 8 articles about 3-(3-chlorophenyl)-3-(2-amino-4-oxo-3H,5H-pyrrolo<3,2-d>pyrimidin-7-yl)propanenitrile 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: 19.5%

: 151332-09-1
N-benzoyl-N'-<4-<2-cyano-1-(3-chlorophenyl)ethyl>-2-(methoxycarbonyl)-1H-pyrrol-3-yl>-S-methylthiourea

: 139367-69-4
3-(3-chlorophenyl)-3-(2-amino-4-oxo-3H,5H-pyrrolo<3,2-d>pyrimidin-7-yl)propanenitrile

: 153227-38-4
3-<2-(methylthio)-4-oxo-3H,5H-pyrrolo<3,2-d>pyrimidin-7-yl>-3-(3-chlorophenyl)propanenitrile

Guidance literature:: With ammonia; In methanol; at 100 ℃; for 20h;
DOI:10.1021/jm00076a004

Reference yield:

: 587-04-2
m-Chlorobenzaldehyde

: 139367-69-4
3-(3-chlorophenyl)-3-(2-amino-4-oxo-3H,5H-pyrrolo<3,2-d>pyrimidin-7-yl)propanenitrile

Guidance literature:: Multi-step reaction with 8 steps

1: 69 percent / piperidine / pyridine / 8 h

2: NaH / tetrahydrofuran / 1.) from 5 to 10 deg C, 2 h, 2.) RT, overnight

3: 60.5 percent / NaOAc / H₂O; methanol / 22 h / Ambient temperature

4: DBN / CH₂Cl₂ / 1.) 0 deg C, 1 h, 2.) RT, 48 h

5: 16.28 g / Na₂CO₃ / methanol / 17 h / Ambient temperature

6: 94 percent / CH₂Cl₂ / 1 h / Ambient temperature

7: DBN / CH₂Cl₂ / 1.) 0 deg C, 10 min, 2.) RT, 1 h

8: 49.8 percent / NH₃ / methanol / 20 h / 100 °C

With piperidine; 2,6-dichloro-benzonitrile; ammonia; sodium acetate; sodium hydride; sodium carbonate; In tetrahydrofuran; pyridine; methanol; dichloromethane; water;
DOI:10.1021/jm00076a004

Reference yield:

: 135851-20-6
3-(3-chlorophenyl)pentanedinitrile

: 139367-69-4
3-(3-chlorophenyl)-3-(2-amino-4-oxo-3H,5H-pyrrolo<3,2-d>pyrimidin-7-yl)propanenitrile

Guidance literature:: Multi-step reaction with 7 steps

1: NaH / tetrahydrofuran / 1.) from 5 to 10 deg C, 2 h, 2.) RT, overnight

2: 60.5 percent / NaOAc / H₂O; methanol / 22 h / Ambient temperature

3: DBN / CH₂Cl₂ / 1.) 0 deg C, 1 h, 2.) RT, 48 h

4: 16.28 g / Na₂CO₃ / methanol / 17 h / Ambient temperature

5: 94 percent / CH₂Cl₂ / 1 h / Ambient temperature

6: DBN / CH₂Cl₂ / 1.) 0 deg C, 10 min, 2.) RT, 1 h

7: 49.8 percent / NH₃ / methanol / 20 h / 100 °C

With 2,6-dichloro-benzonitrile; ammonia; sodium acetate; sodium hydride; sodium carbonate; In tetrahydrofuran; methanol; dichloromethane; water;
DOI:10.1021/jm00076a004