3-[3-(4-Carbamimidoyl-benzoylamino)-propionylamino]-propionic acid benzyl ester

Base Information

• Chemical Name: 3-[3-(4-Carbamimidoyl-benzoylamino)-propionylamino]-propionic acid benzyl ester
• CAS No.: 1027306-51-9
• Molecular Formula: C₂₁H₂₄N₄O₄
• Molecular Weight: 396.446
• Mol file: 1027306-51-9.mol

Synonyms:3-[3-(4-Carbamimidoyl-benzoylamino)-propionylamino]-propionic acid benzyl ester

Chemical Property of 3-[3-(4-Carbamimidoyl-benzoylamino)-propionylamino]-propionic acid benzyl ester

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

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Technology Process of 3-[3-(4-Carbamimidoyl-benzoylamino)-propionylamino]-propionic acid benzyl ester

There total 4 articles about 3-[3-(4-Carbamimidoyl-benzoylamino)-propionylamino]-propionic acid benzyl ester 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:

4-(aminoiminomethyl)benzoic acid (15535-95-2) → 3-[3-(4-Carbamimidoyl-benzoylamino)-propionylamino]-propionic acid benzyl ester (1027306-51-9)

Guidance literature:

Multi-step reaction with 2 steps

1: thionyl chloride / tetrahydrofuran; dimethylformamide / 20 °C

2: NaHCO₃ / CH₂Cl₂; H₂O

With thionyl chloride; sodium hydrogencarbonate; In tetrahydrofuran; dichloromethane; water; N,N-dimethyl-formamide;

DOI:10.1021/jm00101a017

Reference yield:

benzyl 3-aminopropionate (14529-00-1) → 3-[3-(4-Carbamimidoyl-benzoylamino)-propionylamino]-propionic acid benzyl ester (1027306-51-9)

Guidance literature:

Multi-step reaction with 3 steps

1: 1.)2-chloro-4,6-dimethoxy-1,3,5-triazine (CDMT), N-methylmorpholine (NMM), 2.) N-methylmorpholine (NMM) / 1.) CH₂Cl₂, 0 deg C, 3 h, 2.) CH₂Cl₂, RT, 12 h

2: trifluoroacetic acid (TFA) / CH₂Cl₂ / 2 h / Ambient temperature

3: NaHCO₃ / CH₂Cl₂; H₂O

With 4-methyl-morpholine; 2-chloro-4,6-dimethoxy-1 ,3,5-triazine; sodium hydrogencarbonate; trifluoroacetic acid; In dichloromethane; water;

DOI:10.1021/jm00101a017

Reference yield:

benzyl 3-(3-(tert-butoxycarbonylamino)propanamido)propanoate (138108-37-9) → 3-[3-(4-Carbamimidoyl-benzoylamino)-propionylamino]-propionic acid benzyl ester (1027306-51-9)

Guidance literature:

Multi-step reaction with 2 steps

1: trifluoroacetic acid (TFA) / CH₂Cl₂ / 2 h / Ambient temperature

2: NaHCO₃ / CH₂Cl₂; H₂O

With sodium hydrogencarbonate; trifluoroacetic acid; In dichloromethane; water;

DOI:10.1021/jm00101a017

upstream raw materials:

3-(3-Amino-propionylamino)-propionic acid benzyl ester

4-(aminoiminomethyl)benzoic acid

benzyl 3-aminopropionate

benzyl 3-(3-(tert-butoxycarbonylamino)propanamido)propanoate

Downstream raw materials:

N-[N-[p-[N-(benzyloxycarbonyl)amidino]benzoyl]-β-alanyl]-β-alanine benzylester