octyl 3-amino-5-[(5'-hexanoamido-2'-octyloxy)phenylcarbonylaminomethylcarbonylamino]-benzoate

Base Information

• Chemical Name: octyl 3-amino-5-[(5'-hexanoamido-2'-octyloxy)phenylcarbonylaminomethylcarbonylamino]-benzoate
• CAS No.: 345625-93-6
• Molecular Formula: C₃₈H₅₈N₄O₆
• Molecular Weight: 666.902

Synonyms:octyl 3-amino-5-[(5'-hexanoamido-2'-octyloxy)phenylcarbonylaminomethylcarbonylamino]-benzoate

Chemical Property of octyl 3-amino-5-[(5'-hexanoamido-2'-octyloxy)phenylcarbonylaminomethylcarbonylamino]-benzoate

Chemical Property:

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Technology Process of octyl 3-amino-5-[(5'-hexanoamido-2'-octyloxy)phenylcarbonylaminomethylcarbonylamino]-benzoate

There total 4 articles about octyl 3-amino-5-[(5'-hexanoamido-2'-octyloxy)phenylcarbonylaminomethylcarbonylamino]-benzoate 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%

octyl 3,5-diaminobenzoate (146223-61-2) + N-carboxymethyl-5-hexanoamido-2-octyloxybenzamide (345625-92-5) → octyl 3-amino-5-[(5'-hexanoamido-2'-octyloxy)phenylcarbonylaminomethylcarbonylamino]-benzoate (345625-93-6)

Guidance literature:

With benzotriazol-1-ol; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; In dichloromethane; for 6h;

DOI:10.1021/ja010701b

Reference yield:

Hexanoyl chloride (142-61-0) → octyl 3-amino-5-[(5'-hexanoamido-2'-octyloxy)phenylcarbonylaminomethylcarbonylamino]-benzoate (345625-93-6)

Guidance literature:

Multi-step reaction with 3 steps

1: 89 percent / Et₃N / CH₂Cl₂ / 6 h

2: 96 percent / aq. NaOH / methanol / 0.5 h / Heating

3: 76 percent / EDC; HOBT / CH₂Cl₂ / 6 h

With sodium hydroxide; benzotriazol-1-ol; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; triethylamine; In methanol; dichloromethane;

DOI:10.1021/ja010701b

Reference yield:

N-((ethoxycarbonyl)methyl)-5-amino-2-(octyloxy)benzamide (267897-52-9) → octyl 3-amino-5-[(5'-hexanoamido-2'-octyloxy)phenylcarbonylaminomethylcarbonylamino]-benzoate (345625-93-6)

Guidance literature:

Multi-step reaction with 3 steps

1: 89 percent / Et₃N / CH₂Cl₂ / 6 h

2: 96 percent / aq. NaOH / methanol / 0.5 h / Heating

3: 76 percent / EDC; HOBT / CH₂Cl₂ / 6 h

With sodium hydroxide; benzotriazol-1-ol; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; triethylamine; In methanol; dichloromethane;

DOI:10.1021/ja010701b

upstream raw materials:

octyl 3,5-diaminobenzoate

N-carboxymethyl-5-hexanoamido-2-octyloxybenzamide

Hexanoyl chloride

N-((ethoxycarbonyl)methyl)-5-amino-2-(octyloxy)benzamide

Downstream raw materials:

octyl 3-((((phenylmethoxy)carbonyl)aminomethylcarbonyl)amino)-5-((5'-hexanoamido-2'-octyloxy)phenylcarbonylaminomethylcarbonylamino)-benzoate

3-[2-((S)-2-Benzyloxycarbonylamino-3-phenyl-propionylamino)-acetylamino]-5-[2-(5-hexanoylamino-2-octyloxy-benzoylamino)-acetylamino]-benzoic acid octyl ester

3-{2-[(S)-2-((S)-2-Benzyloxycarbonylamino-propionylamino)-3-phenyl-propionylamino]-acetylamino}-5-[2-(5-hexanoylamino-2-octyloxy-benzoylamino)-acetylamino]-benzoic acid octyl ester

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