1-[3-(6-tert-butyl-1-oxophthalazin-2(1H)-yl)-2-(hydroxymethyl)phenyl]-3-[4-(morpholine-4-carbonyl)phenylamino]-1H-pyrazole-4-carbonitrile

Base Information

• Chemical Name: 1-[3-(6-tert-butyl-1-oxophthalazin-2(1H)-yl)-2-(hydroxymethyl)phenyl]-3-[4-(morpholine-4-carbonyl)phenylamino]-1H-pyrazole-4-carbonitrile
• CAS No.: 1413064-70-6
• Molecular Formula: C₃₄H₃₃N₇O₄
• Molecular Weight: 603.681
• Mol file: 1413064-70-6.mol

Synonyms:1-[3-(6-tert-butyl-1-oxophthalazin-2(1H)-yl)-2-(hydroxymethyl)phenyl]-3-[4-(morpholine-4-carbonyl)phenylamino]-1H-pyrazole-4-carbonitrile

Chemical Property of 1-[3-(6-tert-butyl-1-oxophthalazin-2(1H)-yl)-2-(hydroxymethyl)phenyl]-3-[4-(morpholine-4-carbonyl)phenylamino]-1H-pyrazole-4-carbonitrile

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 1-[3-(6-tert-butyl-1-oxophthalazin-2(1H)-yl)-2-(hydroxymethyl)phenyl]-3-[4-(morpholine-4-carbonyl)phenylamino]-1H-pyrazole-4-carbonitrile

There total 5 articles about 1-[3-(6-tert-butyl-1-oxophthalazin-2(1H)-yl)-2-(hydroxymethyl)phenyl]-3-[4-(morpholine-4-carbonyl)phenylamino]-1H-pyrazole-4-carbonitrile 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: 100.0%

1-(3-(6-tert-butyl-1-oxophthalazin-2(1H)-yl)-2-formylphenyl)-3-[4-(morpholine-4-carbonyl)phenylamino]-1H-pyrazole-4-carbonitrile (1413064-66-0) → 1-[3-(6-tert-butyl-1-oxophthalazin-2(1H)-yl)-2-(hydroxymethyl)phenyl]-3-[4-(morpholine-4-carbonyl)phenylamino]-1H-pyrazole-4-carbonitrile (1413064-70-6)

Guidance literature:

With sodium tetrahydroborate; water; In methanol; dichloromethane; at 20 ℃; for 1h;

Reference yield:

1-(2-formyl-3-iodo-phenyl)-3-[4-(morpholine-4-carbonyl)-phenylamino]-1H-pyrazole-4-carbonitrile (1413064-62-6) → 1-[3-(6-tert-butyl-1-oxophthalazin-2(1H)-yl)-2-(hydroxymethyl)phenyl]-3-[4-(morpholine-4-carbonyl)phenylamino]-1H-pyrazole-4-carbonitrile (1413064-70-6)

Guidance literature:

Multi-step reaction with 2 steps

1: sodium hydrogencarbonate; copper(l) iodide / dimethyl sulfoxide / 1 h / 100 °C / Inert atmosphere

2: water; sodium tetrahydroborate / dichloromethane; methanol / 1 h / 20 °C

With sodium tetrahydroborate; copper(l) iodide; water; sodium hydrogencarbonate; In methanol; dichloromethane; dimethyl sulfoxide;

Reference yield:

5-[4-(morpholine-4-carbonyl)-phenylamino]-1-(2-trimethylsilanyl-ethoxymethyl)-1H-pyrazole-4-carbonitrile (1413064-54-6) → 1-[3-(6-tert-butyl-1-oxophthalazin-2(1H)-yl)-2-(hydroxymethyl)phenyl]-3-[4-(morpholine-4-carbonyl)phenylamino]-1H-pyrazole-4-carbonitrile (1413064-70-6)

Guidance literature:

Multi-step reaction with 4 steps

1.1: hydrogenchloride; water / ethanol / 20 °C

1.2: Cooling with ice

2.1: potassium tert-butylate / dimethyl sulfoxide / 0.08 h / 20 °C

2.2: 24 h / 20 °C

3.1: sodium hydrogencarbonate; copper(l) iodide / dimethyl sulfoxide / 1 h / 100 °C / Inert atmosphere

4.1: water; sodium tetrahydroborate / dichloromethane; methanol / 1 h / 20 °C

With hydrogenchloride; sodium tetrahydroborate; copper(l) iodide; potassium tert-butylate; water; sodium hydrogencarbonate; In methanol; ethanol; dichloromethane; dimethyl sulfoxide;

upstream raw materials:

5-[4-(morpholine-4-carbonyl)-phenylamino]-1-(2-trimethylsilanyl-ethoxymethyl)-1H-pyrazole-4-carbonitrile

5-[4-(morpholine-4-carbonyl)-phenylamino]-1H-pyrazole-4-carbonitrile

1-(2-formyl-3-iodo-phenyl)-3-[4-(morpholine-4-carbonyl)-phenylamino]-1H-pyrazole-4-carbonitrile

1-(3-(6-tert-butyl-1-oxophthalazin-2(1H)-yl)-2-formylphenyl)-3-[4-(morpholine-4-carbonyl)phenylamino]-1H-pyrazole-4-carbonitrile

Downstream raw materials:

1-[3-(6-tert-butyl-1-oxo-1H-phthalazin-2-yl)-2-hydroxymethyl-phenyl]-3-[4-(morpholine-4-carbonyl)-phenylamino]-1H-pyrazole-4-carboxylic acid amide