NCB-0846

Base Information

• Chemical Name: NCB-0846
• CAS No.: 1792999-26-8
• Molecular Formula: C₂₁H₂₁N₅O₂
• Molecular Weight: 375.43
• Mol file: 1792999-26-8.mol

Synonyms:

Chemical Property of NCB-0846

Chemical Property:

• Boiling Point: 726.2±70.0 °C(Predicted)
• PKA: 12.87±0.30(Predicted)
• Density: 1.415±0.06 g/cm3(Predicted)
• Storage Temp.: -20°C Freezer
• Solubility.: DMSO (Slightly), Methanol (Slightly)

Purity/Quality:

97% ^*data from raw suppliers

cis-4-?[[2-?(1H-?Benzimidazol-?6-?ylamino)?-?8-?quinazolinyl]?oxy]?-?cyclohexanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Uses: cis-4-?[[2-?(1H-?Benzimidazol-?6-?ylamino)?-?8-?quinazolinyl]?oxy]?-?cyclohexanol inhibits Traf2 and Nck-interacting protein kinase (TNIK). TNIK is involved with Canonical Wnt/b-catenin signalling, which has regulatory roles in maintaining intestinal stem cells and aberration in this pathway has been implicated in colorectal carcinogenesis. TNIK is a therapeutic target.

Technology Process of NCB-0846

There total 5 articles about NCB-0846 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:

N-(1H-benzo[d]imidazole-6-yl)-8-{cis-4-[(tert-butyldimethylsilyl)oxy]cyclohexyl}oxyquinazolin-2-amine → 4-({2-[(1H-benzo[d]imidazol-6-yl)amino]quinazolin-8-yl}oxy)cyclohexanol (1792999-26-8)

Guidance literature:

With hydrogenchloride; In 1,4-dioxane; at 20 ℃; for 1h;

Reference yield:

(1r,4r)-4-((tert-butyldimethylsilyl)oxy)cyclohexyl methanesulfonate → 4-({2-[(1H-benzo[d]imidazol-6-yl)amino]quinazolin-8-yl}oxy)cyclohexanol (1792999-26-8)

Guidance literature:

Multi-step reaction with 2 steps

1: caesium carbonate / dimethyl sulfoxide / 1 h / 130 °C

2: hydrogenchloride / 1,4-dioxane / 1 h / 20 °C

With hydrogenchloride; caesium carbonate; In 1,4-dioxane; dimethyl sulfoxide;

Reference yield:

2-[(1H-benzo[d]imidazol-6-yl)amino]quinazolin-8-ol → 4-({2-[(1H-benzo[d]imidazol-6-yl)amino]quinazolin-8-yl}oxy)cyclohexanol (1792999-26-8)

Guidance literature:

Multi-step reaction with 2 steps

1: caesium carbonate / dimethyl sulfoxide / 1 h / 130 °C

2: hydrogenchloride / 1,4-dioxane / 1 h / 20 °C

With hydrogenchloride; caesium carbonate; In 1,4-dioxane; dimethyl sulfoxide;

upstream raw materials:

2-chloro-8-methoxyquinazoline

2-chloro-8-hydroxyquinazoline