4-[(5-cyclopentyl-4-ethyl-2-methyl-3-oxo-2,4,5,7,9-pentazabicyclo[4.4.0]deca-6,8,10-trien-8-yl)amino]-2-fluoro-5-methoxy-N-(1-methyl-4-piperidyl)benzamide

Base Information

• Chemical Name: 4-[(5-cyclopentyl-4-ethyl-2-methyl-3-oxo-2,4,5,7,9-pentazabicyclo[4.4.0]deca-6,8,10-trien-8-yl)amino]-2-fluoro-5-methoxy-N-(1-methyl-4-piperidyl)benzamide
• CAS No.: 1018317-68-4
• Molecular Formula: C₂₇H₃₇FN₈O₃
• Molecular Weight: 540.641
• Mol file: 1018317-68-4.mol

Synonyms:4-[(5-cyclopentyl-4-ethyl-2-methyl-3-oxo-2,4,5,7,9-pentazabicyclo[4.4.0]deca-6,8,10-trien-8-yl)amino]-2-fluoro-5-methoxy-N-(1-methyl-4-piperidyl)benzamide

Chemical Property of 4-[(5-cyclopentyl-4-ethyl-2-methyl-3-oxo-2,4,5,7,9-pentazabicyclo[4.4.0]deca-6,8,10-trien-8-yl)amino]-2-fluoro-5-methoxy-N-(1-methyl-4-piperidyl)benzamide

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 4-[(5-cyclopentyl-4-ethyl-2-methyl-3-oxo-2,4,5,7,9-pentazabicyclo[4.4.0]deca-6,8,10-trien-8-yl)amino]-2-fluoro-5-methoxy-N-(1-methyl-4-piperidyl)benzamide

There total 6 articles about 4-[(5-cyclopentyl-4-ethyl-2-methyl-3-oxo-2,4,5,7,9-pentazabicyclo[4.4.0]deca-6,8,10-trien-8-yl)amino]-2-fluoro-5-methoxy-N-(1-methyl-4-piperidyl)benzamide 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: 44.0%

4-amino-5-methoxy-2-fluoro-N-(1-methyl-piperidin-4-yl)-benzamide (1001345-78-3) + 8-chloro-5-cyclopentyl-4-ethyI-2-methyl-2,4,5,7,9-pentazabicyclo[4.4.0]deca-7,9,11-trien-3-one (1018318-03-0) → 4-[(5-cyclopentyl-4-ethyl-2-methyl-3-oxo-2,4,5,7,9-pentazabicyclo[4.4.0]deca-6,8,10-trien-8-yl)amino]-2-fluoro-5-methoxy-N-(1-methyl-4-piperidyl)benzamide (1018317-68-4)

Guidance literature:

With toluene-4-sulfonic acid; In Methyl isobutyl carbinol; at 110 ℃; for 24h;

Reference yield:

2‐fluoro‐5‐methoxy‐4‐nitrobenzoic acid (1001345-80-7) → 4-[(5-cyclopentyl-4-ethyl-2-methyl-3-oxo-2,4,5,7,9-pentazabicyclo[4.4.0]deca-6,8,10-trien-8-yl)amino]-2-fluoro-5-methoxy-N-(1-methyl-4-piperidyl)benzamide (1018317-68-4)

Guidance literature:

Multi-step reaction with 3 steps

1: N-ethyl-N,N-diisopropylamine; HATU / N,N-dimethyl acetamide / 1 h / 18 - 25 °C

2: hydrogen / palladium 10% on activated carbon / methanol / 18 h / 25 °C / 750.08 Torr

3: toluene-4-sulfonic acid / Methyl isobutyl carbinol / 24 h / 110 °C

With hydrogen; toluene-4-sulfonic acid; N-ethyl-N,N-diisopropylamine; HATU; palladium 10% on activated carbon; In methanol; Methyl isobutyl carbinol; N,N-dimethyl acetamide;

Reference yield:

2-fluoro-5-methoxy-N-(1-methylpiperidin-4-yl)-4-nitrobenzamide (1001345-79-4) → 4-[(5-cyclopentyl-4-ethyl-2-methyl-3-oxo-2,4,5,7,9-pentazabicyclo[4.4.0]deca-6,8,10-trien-8-yl)amino]-2-fluoro-5-methoxy-N-(1-methyl-4-piperidyl)benzamide (1018317-68-4)

Guidance literature:

Multi-step reaction with 2 steps

1: hydrogen / palladium 10% on activated carbon / methanol / 18 h / 25 °C / 750.08 Torr

2: toluene-4-sulfonic acid / Methyl isobutyl carbinol / 24 h / 110 °C

With hydrogen; toluene-4-sulfonic acid; palladium 10% on activated carbon; In methanol; Methyl isobutyl carbinol;

upstream raw materials:

4-amino-5-methoxy-2-fluoro-N-(1-methyl-piperidin-4-yl)-benzamide

8-chloro-5-cyclopentyl-4-ethyI-2-methyl-2,4,5,7,9-pentazabicyclo[4.4.0]deca-7,9,11-trien-3-one

2‐fluoro‐5‐methoxy‐4‐nitrobenzoic acid

2-fluoro-5-methoxy-N-(1-methylpiperidin-4-yl)-4-nitrobenzamide

Refernces