Sorafenib-d3

Base Information

• Chemical Name: Sorafenib-d3
• CAS No.: 1130115-44-4
• Molecular Formula: C21H16ClF3N4O3
• Molecular Weight: 467.807
• Mol file: 1130115-44-4.mol

Synonyms:Donafenib Tosylate

Chemical Property of Sorafenib-d3

Chemical Property:

• Melting Point: 202-204?C
• PSA: 92.35000
• LogP: 6.08660
• Storage Temp.: -20°C Freezer

Purity/Quality:

99% ^*data from raw suppliers

Sorafenib-d3 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Uses: Labelled Sorafenib, a potent RAF kinase inhibitor. Antineoplastic.

Technology Process of Sorafenib-d3

There total 18 articles about Sorafenib-d3 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: 95.4%

4-(4-aminophenoxy)-2-pyridine-(N-(methyl-d3))carboxamide (1189975-18-5) + 4-chloro-3-(trifluoromethyl)phenyl isocyanate (327-78-6) → N-(4-chloro-3-(trifluoromethyl)phenyl)-N'-(4-(2-(N-(methyl-d3)aminoformyl)-4-pyridyloxy)phenyl)urea (1130115-44-4)

Guidance literature:

In dichloromethane; dimethyl sulfoxide; at 20 ℃; for 0.333333h; Inert atmosphere;

Reference yield: 86.0%

methyl 4‐(4‐(3‐(4‐chloro‐3‐(trifluoromethyl)phenyl)ureido)phenoxy)picolinate (573673-43-5) + methyl-d3-amine hydrochloride (7436-22-8) → N-(4-chloro-3-(trifluoromethyl)phenyl)-N'-(4-(2-(N-(methyl-d3)aminoformyl)-4-pyridyloxy)phenyl)urea (1130115-44-4)

Guidance literature:

With potassium carbonate; In tetrahydrofuran; at 20 ℃; for 20h;

Reference yield: 81.0%

4-[4-[[[[4-chloro-3-(trifluoromethyl)phenyl]amino]carbonyl]amino]phenoxy]-2-pyridinecarboxylic acid (1012058-78-4) + methyl-d3-amine hydrochloride (7436-22-8) → N-(4-chloro-3-(trifluoromethyl)phenyl)-N'-(4-(2-(N-(methyl-d3)aminoformyl)-4-pyridyloxy)phenyl)urea (1130115-44-4)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; HATU; In N,N-dimethyl-formamide; at 20 ℃; for 16h;

upstream raw materials:

4-chloropyridinyl-2-(N-1',1',1'-trideuteromethylcarboxamide)

N-[4-chloro-3-(trifluoromethyl)phenyl]-1H-imidazole-1-carboxamide

4-(4-aminophenoxy)-2-pyridine-(N-(methyl-d₃))carboxamide

nicotinic acid

Downstream raw materials:

4-(4-(3-(4-chloro-3-trifluoromethylphenyl)ureido)phenoxyl)-2-(N-1’,1’,1’-trideuteromethyl)pyridine amide p-toluenesulfonate