6-[4-methoxy-3-(1H-pyrazol-1-ylmethyl)benzyl]-1,11-dimethyl-3,6,9-triazatricyclo[7.3.1.1^3,11]tetradecane-4,8,12-trione

Base Information

• Chemical Name: 6-[4-methoxy-3-(1H-pyrazol-1-ylmethyl)benzyl]-1,11-dimethyl-3,6,9-triazatricyclo[7.3.1.1^3,11]tetradecane-4,8,12-trione
• CAS No.: 1402349-27-2
• Molecular Formula: C₂₅H₃₁N₅O₄
• Molecular Weight: 465.552
• Mol file: 1402349-27-2.mol

Synonyms:6-[4-methoxy-3-(1H-pyrazol-1-ylmethyl)benzyl]-1,11-dimethyl-3,6,9-triazatricyclo[7.3.1.1^3,11]tetradecane-4,8,12-trione

Chemical Property of 6-[4-methoxy-3-(1H-pyrazol-1-ylmethyl)benzyl]-1,11-dimethyl-3,6,9-triazatricyclo[7.3.1.1^3,11]tetradecane-4,8,12-trione

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 6-[4-methoxy-3-(1H-pyrazol-1-ylmethyl)benzyl]-1,11-dimethyl-3,6,9-triazatricyclo[7.3.1.1^3,11]tetradecane-4,8,12-trione

There total 3 articles about 6-[4-methoxy-3-(1H-pyrazol-1-ylmethyl)benzyl]-1,11-dimethyl-3,6,9-triazatricyclo[7.3.1.1^3,11]tetradecane-4,8,12-trione 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: 76.0%

[4-methoxy-3-(1H-pyrazol-1-ylmethyl)benzyl]amine (956352-90-2) + 3,7-bis(chloroacetyl)-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one (488129-42-6) → 6-[4-methoxy-3-(1H-pyrazol-1-ylmethyl)benzyl]-1,11-dimethyl-3,6,9-triazatricyclo[7.3.1.13,11]tetradecane-4,8,12-trione (1402349-27-2)

Guidance literature:

With potassium carbonate; In acetonitrile; at 60 ℃;

DOI:10.1016/j.mencom.2018.05.028

Reference yield:

3-((1H-pyrazol-1-yl)methyl)-4-methoxybenzaldehyde (436086-89-4) → 6-[4-methoxy-3-(1H-pyrazol-1-ylmethyl)benzyl]-1,11-dimethyl-3,6,9-triazatricyclo[7.3.1.13,11]tetradecane-4,8,12-trione (1402349-27-2)

Guidance literature:

Multi-step reaction with 3 steps

1: hydroxylamine hydrochloride; pyridine / ethanol

2: lithium aluminium tetrahydride / tetrahydrofuran

3: potassium carbonate / acetonitrile / 60 °C

With pyridine; lithium aluminium tetrahydride; hydroxylamine hydrochloride; potassium carbonate; In tetrahydrofuran; ethanol; acetonitrile;

DOI:10.1016/j.mencom.2018.05.028

Reference yield:

3-(chloromethyl)-4-methoxybenzaldehyde (52577-09-0) → 6-[4-methoxy-3-(1H-pyrazol-1-ylmethyl)benzyl]-1,11-dimethyl-3,6,9-triazatricyclo[7.3.1.13,11]tetradecane-4,8,12-trione (1402349-27-2)

Guidance literature:

Multi-step reaction with 4 steps

1: 18-crown-6 ether; potassium hydroxide / benzene; water / 80 °C

2: hydroxylamine hydrochloride; pyridine / ethanol

3: lithium aluminium tetrahydride / tetrahydrofuran

4: potassium carbonate / acetonitrile / 60 °C

With pyridine; lithium aluminium tetrahydride; 18-crown-6 ether; hydroxylamine hydrochloride; potassium carbonate; potassium hydroxide; In tetrahydrofuran; ethanol; water; acetonitrile; benzene;

DOI:10.1016/j.mencom.2018.05.028

upstream raw materials:

[4-methoxy-3-(1H-pyrazol-1-ylmethyl)benzyl]amine

3,7-bis(chloroacetyl)-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one

3-(chloromethyl)-4-methoxybenzaldehyde

3-((1H-pyrazol-1-yl)methyl)-4-methoxybenzaldehyde