(+/-)-2-(1-aminopropyl)-3-benzyl-6-chloro-3-H-pyrrolo[2,1-f][1,2,4]triazine-4-one

Base Information

• Chemical Name: (+/-)-2-(1-aminopropyl)-3-benzyl-6-chloro-3-H-pyrrolo[2,1-f][1,2,4]triazine-4-one
• CAS No.: 628733-87-9
• Molecular Formula: C₁₆H₁₇ClN₄O
• Molecular Weight: 316.79
• Mol file: 628733-87-9.mol

Synonyms:(+/-)-2-(1-aminopropyl)-3-benzyl-6-chloro-3-H-pyrrolo[2,1-f][1,2,4]triazine-4-one

Chemical Property of (+/-)-2-(1-aminopropyl)-3-benzyl-6-chloro-3-H-pyrrolo[2,1-f][1,2,4]triazine-4-one

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of (+/-)-2-(1-aminopropyl)-3-benzyl-6-chloro-3-H-pyrrolo[2,1-f][1,2,4]triazine-4-one

There total 6 articles about (+/-)-2-(1-aminopropyl)-3-benzyl-6-chloro-3-H-pyrrolo[2,1-f][1,2,4]triazine-4-one 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: 25.0%

(+/-)-methyl 1-{[N-benzyl-2-FMOC-aminobutyrimidoyl]amino}-4-chloro-1H-pyrrolo-2-carboxylate (628733-86-8) → (+/-)-2-(1-aminopropyl)-3-benzyl-6-chloro-3-H-pyrrolo[2,1-f][1,2,4]triazine-4-one (628733-87-9)

Guidance literature:

at 150 ℃; for 6h;

Reference yield:

[1-(3-benzyl-6-chloro-4-oxo-3,4-dihydro-pyrrolo[2,1-f][1,2,4]triazin-2-yl)-propyl]-carbamic acid 9H-fluoren-9-ylmethyl ester (906672-43-3) → (+/-)-2-(1-aminopropyl)-3-benzyl-6-chloro-3-H-pyrrolo[2,1-f][1,2,4]triazine-4-one (628733-87-9)

Guidance literature:

With piperidine; In N,N-dimethyl-formamide;

DOI:10.1016/j.bmcl.2006.05.037

Reference yield:

1-amino-4-chloro-1H-pyrrole-2-carboxylic acid methyl ester (791780-57-9) → (+/-)-2-(1-aminopropyl)-3-benzyl-6-chloro-3-H-pyrrolo[2,1-f][1,2,4]triazine-4-one (628733-87-9)

Guidance literature:

Multi-step reaction with 3 steps

1: EDCI*HCl / CH₂Cl₂ / 20 °C

2: 25 percent / xylene / 7 h / 130 °C

3: piperidine / dimethylformamide

With piperidine; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In dichloromethane; N,N-dimethyl-formamide; xylene;

DOI:10.1016/j.bmcl.2006.05.037

upstream raw materials:

[1-(3-benzyl-6-chloro-4-oxo-3,4-dihydro-pyrrolo[2,1-f][1,2,4]triazin-2-yl)-propyl]-carbamic acid 9H-fluoren-9-ylmethyl ester

1-amino-4-chloro-1H-pyrrole-2-carboxylic acid methyl ester

(+/-)-N'-benzyl-N-FMOC-2-aminobutyrylthioamide

1-{[N-benzyl-2-(9H-fluoren-9-ylmethoxycarbonylamino)-butyrimidoyl]-amino}-4-chloro-1H-pyrrole-2-carboxylic acid methyl ester

Downstream raw materials:

(+/-)-N-(3-N-BOC-aminopropyl)-N-[1-(3-benzyl-6-chloro-4-oxo-3,4-dihydropyrrolo [2,1-f][1,2,4]triazine-2-yl)]propylamine