3-[(S)-3-[4-(4-Amino-butyryl)-piperazin-1-yl]-3-oxo-2-(2,4,6-triisopropyl-benzenesulfonylamino)-propyl]-benzamidine

Base Information

• Chemical Name: 3-[(S)-3-[4-(4-Amino-butyryl)-piperazin-1-yl]-3-oxo-2-(2,4,6-triisopropyl-benzenesulfonylamino)-propyl]-benzamidine
• CAS No.: 797040-25-6
• Molecular Formula: C₃₃H₅₀N₆O₄S
• Molecular Weight: 626.864
• Mol file: 797040-25-6.mol

Synonyms:3-[(S)-3-[4-(4-Amino-butyryl)-piperazin-1-yl]-3-oxo-2-(2,4,6-triisopropyl-benzenesulfonylamino)-propyl]-benzamidine

Chemical Property of 3-[(S)-3-[4-(4-Amino-butyryl)-piperazin-1-yl]-3-oxo-2-(2,4,6-triisopropyl-benzenesulfonylamino)-propyl]-benzamidine

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 3-[(S)-3-[4-(4-Amino-butyryl)-piperazin-1-yl]-3-oxo-2-(2,4,6-triisopropyl-benzenesulfonylamino)-propyl]-benzamidine

There total 5 articles about 3-[(S)-3-[4-(4-Amino-butyryl)-piperazin-1-yl]-3-oxo-2-(2,4,6-triisopropyl-benzenesulfonylamino)-propyl]-benzamidine 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:

C35H52N6O6S → 3-[(S)-3-[4-(4-Amino-butyryl)-piperazin-1-yl]-3-oxo-2-(2,4,6-triisopropyl-benzenesulfonylamino)-propyl]-benzamidine (797040-25-6)

Guidance literature:

With hydrogen; acetic acid; palladium on activated charcoal; at 40 ℃;

DOI:10.1021/jm051272l

Reference yield:

3-[3-(N-hydroxycarbamimidoyl)-phenyl]-2-(2,4,6-triisopropyl-benzenesulfonylamino)-propionic acid (797040-05-2) → 3-[(S)-3-[4-(4-Amino-butyryl)-piperazin-1-yl]-3-oxo-2-(2,4,6-triisopropyl-benzenesulfonylamino)-propyl]-benzamidine (797040-25-6)

Guidance literature:

Multi-step reaction with 4 steps

1: AcOH / 20 °C

2: PyBop; diisopropylethylamine / dimethylformamide / 0 - 20 °C

3: aq. HCl; AcOH / 20 °C

4: aq. AcOH; H₂ / Pd/C / 40 °C

With hydrogenchloride; benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; hydrogen; acetic acid; N-ethyl-N,N-diisopropylamine; palladium on activated charcoal; In N,N-dimethyl-formamide;

DOI:10.1021/jm051272l

Reference yield:

Nα-2,4,6-Triisopropylphenylsulfonyl-(L)-3-cyano-phenylalanine (255374-80-2) → 3-[(S)-3-[4-(4-Amino-butyryl)-piperazin-1-yl]-3-oxo-2-(2,4,6-triisopropyl-benzenesulfonylamino)-propyl]-benzamidine (797040-25-6)

Guidance literature:

Multi-step reaction with 5 steps

1: hydroxylamine*HCl; diisopropylethylamine / ethanol / Heating

2: AcOH / 20 °C

3: PyBop; diisopropylethylamine / dimethylformamide / 0 - 20 °C

4: aq. HCl; AcOH / 20 °C

5: aq. AcOH; H₂ / Pd/C / 40 °C

With hydrogenchloride; hydroxylamine hydrochloride; benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; hydrogen; acetic acid; N-ethyl-N,N-diisopropylamine; palladium on activated charcoal; In ethanol; N,N-dimethyl-formamide;

DOI:10.1021/jm051272l

upstream raw materials:

Nα-2,4,6-Triisopropylphenylsulfonyl-(L)-3-cyano-phenylalanine

3-[3-(N-hydroxycarbamimidoyl)-phenyl]-2-(2,4,6-triisopropyl-benzenesulfonylamino)-propionic acid

C₂₇H₃₇N₃O₆S