5-((((5-methoxycarbonyl-2,4-dioctyloxy)phenylcarbonyl)aminomethylcarbonyl)amino)-2-octyloxy-N-hexylbenzamide

Base Information

• Chemical Name: 5-((((5-methoxycarbonyl-2,4-dioctyloxy)phenylcarbonyl)aminomethylcarbonyl)amino)-2-octyloxy-N-hexylbenzamide
• CAS No.: 416899-34-8
• Molecular Formula: C₄₈H₇₇N₃O₈
• Molecular Weight: 824.155
• Mol file: 416899-34-8.mol

Synonyms:5-((((5-methoxycarbonyl-2,4-dioctyloxy)phenylcarbonyl)aminomethylcarbonyl)amino)-2-octyloxy-N-hexylbenzamide

Chemical Property of 5-((((5-methoxycarbonyl-2,4-dioctyloxy)phenylcarbonyl)aminomethylcarbonyl)amino)-2-octyloxy-N-hexylbenzamide

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 5-((((5-methoxycarbonyl-2,4-dioctyloxy)phenylcarbonyl)aminomethylcarbonyl)amino)-2-octyloxy-N-hexylbenzamide

There total 12 articles about 5-((((5-methoxycarbonyl-2,4-dioctyloxy)phenylcarbonyl)aminomethylcarbonyl)amino)-2-octyloxy-N-hexylbenzamide 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: 93.0%

5-(aminomethylcarbonylamino)-2-octyloxy-N-hexylbenzamide (416899-33-7) + 4,6-bis-octyloxyisophthalic acid monomethyl ester (345625-94-7) → 5-((((5-methoxycarbonyl-2,4-dioctyloxy)phenylcarbonyl)aminomethylcarbonyl)amino)-2-octyloxy-N-hexylbenzamide (416899-34-8)

Guidance literature:

4,6-bis-octyloxyisophthalic acid monomethyl ester; With O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; for 0.25h; Inert atmosphere;

5-(aminomethylcarbonylamino)-2-octyloxy-N-hexylbenzamide; In N,N-dimethyl-formamide; for 4h; Inert atmosphere;

DOI:10.1002/anie.201504838

Reference yield:

5-(((phenylmethoxy)carbonyl)aminomethylcarbonylamino)-2-octyloxy-N-hexylbenzamide (416899-32-6) → 5-((((5-methoxycarbonyl-2,4-dioctyloxy)phenylcarbonyl)aminomethylcarbonyl)amino)-2-octyloxy-N-hexylbenzamide (416899-34-8)

Guidance literature:

Multi-step reaction with 2 steps

1: 96 percent / hydrogen / Pd-C / methanol; dimethylformamide / 30 - 40 °C

2: 52 percent / EDC; HOBT / CH₂Cl₂ / Heating

With hydrogen; benzotriazol-1-ol; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; palladium on activated charcoal; In methanol; dichloromethane; N,N-dimethyl-formamide;

DOI:10.1021/ja010701b

Reference yield:

N-hexyl-5-amino-2-(octyloxy)benzamide (267897-53-0) → 5-((((5-methoxycarbonyl-2,4-dioctyloxy)phenylcarbonyl)aminomethylcarbonyl)amino)-2-octyloxy-N-hexylbenzamide (416899-34-8)

Guidance literature:

Multi-step reaction with 3 steps

1: 64 percent / EDC; HOBT / CH₂Cl₂

2: 96 percent / hydrogen / Pd-C / methanol; dimethylformamide / 30 - 40 °C

3: 52 percent / EDC; HOBT / CH₂Cl₂ / Heating

With hydrogen; benzotriazol-1-ol; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; palladium on activated charcoal; In methanol; dichloromethane; N,N-dimethyl-formamide;

DOI:10.1021/ja010701b

upstream raw materials:

5-(aminomethylcarbonylamino)-2-octyloxy-N-hexylbenzamide

4,6-bis-octyloxyisophthalic acid monomethyl ester

5-(((phenylmethoxy)carbonyl)aminomethylcarbonylamino)-2-octyloxy-N-hexylbenzamide

N-hexyl-5-amino-2-(octyloxy)benzamide

Downstream raw materials:

5-((((5-hydroxycarbonyl-2,4-dioctyloxy)phenylcarbonyl)aminomethylcarbonyl)ammino)-2-octyloxy-N-hexylbenzamide