3-(4-chloro-6-(((1S,2R,5S)-6,6-dimethylbicyclo[3.1.1]heptan-2-yl)methylamino)-1,3,5-triazin-2-ylamino)-4-methylbenzamide

Base Information

• Chemical Name: 3-(4-chloro-6-(((1S,2R,5S)-6,6-dimethylbicyclo[3.1.1]heptan-2-yl)methylamino)-1,3,5-triazin-2-ylamino)-4-methylbenzamide
• CAS No.: 780790-79-6
• Molecular Formula: C₂₁H₂₇ClN₆O
• Molecular Weight: 414.938
• Mol file: 780790-79-6.mol

Synonyms:3-(4-chloro-6-(((1S,2R,5S)-6,6-dimethylbicyclo[3.1.1]heptan-2-yl)methylamino)-1,3,5-triazin-2-ylamino)-4-methylbenzamide

Chemical Property of 3-(4-chloro-6-(((1S,2R,5S)-6,6-dimethylbicyclo[3.1.1]heptan-2-yl)methylamino)-1,3,5-triazin-2-ylamino)-4-methylbenzamide

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 3-(4-chloro-6-(((1S,2R,5S)-6,6-dimethylbicyclo[3.1.1]heptan-2-yl)methylamino)-1,3,5-triazin-2-ylamino)-4-methylbenzamide

There total 2 articles about 3-(4-chloro-6-(((1S,2R,5S)-6,6-dimethylbicyclo[3.1.1]heptan-2-yl)methylamino)-1,3,5-triazin-2-ylamino)-4-methylbenzamide 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:

(-)-cis-myrtanylamine (73522-42-6) + 3-(4,6-dichloro-1,3,5-triazin-2-ylamino)-4-methylbenzamide (348165-94-6) → 3-(4-chloro-6-(((1S,2R,5S)-6,6-dimethylbicyclo[3.1.1]heptan-2-yl)methylamino)-1,3,5-triazin-2-ylamino)-4-methylbenzamide (780790-79-6)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In tetrahydrofuran; at 0 - 20 ℃;

DOI:10.1021/jm049521d

Reference yield:

3-Amino-4-methyl-benzamide (19406-86-1) → 3-(4-chloro-6-(((1S,2R,5S)-6,6-dimethylbicyclo[3.1.1]heptan-2-yl)methylamino)-1,3,5-triazin-2-ylamino)-4-methylbenzamide (780790-79-6)

Guidance literature:

Multi-step reaction with 2 steps

1: acetone / 4 h / 0 - 20 °C

2: diisopropylethylamine / tetrahydrofuran / 0 - 20 °C

With N-ethyl-N,N-diisopropylamine; In tetrahydrofuran; acetone;

DOI:10.1021/jm049521d

Reference yield: 65.0%

3-(4-chloro-6-(((1S,2R,5S)-6,6-dimethylbicyclo[3.1.1]heptan-2-yl)methylamino)-1,3,5-triazin-2-ylamino)-4-methylbenzamide (780790-79-6) → 3-{4-Amino-6-[((1S,2R,5S)-6,6-dimethyl-bicyclo[3.1.1]hept-2-ylmethyl)-amino]-[1,3,5]triazin-2-ylamino}-4-methyl-benzamide

Guidance literature:

With ammonium hydroxide; In ethanol; at 150 ℃; for 1h;

DOI:10.1021/jm049521d

upstream raw materials:

(-)-cis-myrtanylamine

3-(4,6-dichloro-1,3,5-triazin-2-ylamino)-4-methylbenzamide

3-Amino-4-methyl-benzamide

Downstream raw materials:

(R)-3-{4-(5-Carbamoyl-2-methyl-phenylamino)-6-[((1S,2R,5S)-6,6-dimethyl-bicyclo[3.1.1]hept-2-ylmethyl)-amino]-[1,3,5]triazin-2-ylamino}-pyrrolidine-1-carboxylic acid tert-butyl ester