3-{4-[4-(1H-benzoimidazol-2-ylamino)-piperidin-1-yl]-benzoylamino}-2-(4-nitro-benzenesulfonylamino)-propionic acid

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Chemical Name:3-{4-[4-(1H-benzoimidazol-2-ylamino)-piperidin-1-yl]-benzoylamino}-2-(4-nitro-benzenesulfonylamino)-propionic acid
CAS No.:247034-00-0
Molecular Formula:C₂₈H₂₉N₇O₇S
Molecular Weight:607.647
Hs Code.:

3-{4-[4-(1<i>H</i>-benzoimidazol-2-ylamino)-piperidin-1-yl]-benzoylamino}-2-(4-nitro-benzenesulfonylamino)-propionic acid

Synonyms:3-{4-[4-(1H-benzoimidazol-2-ylamino)-piperidin-1-yl]-benzoylamino}-2-(4-nitro-benzenesulfonylamino)-propionic acid

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Chemical Property of 3-{4-[4-(1H-benzoimidazol-2-ylamino)-piperidin-1-yl]-benzoylamino}-2-(4-nitro-benzenesulfonylamino)-propionic acid

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Technology Process of 3-{4-[4-(1H-benzoimidazol-2-ylamino)-piperidin-1-yl]-benzoylamino}-2-(4-nitro-benzenesulfonylamino)-propionic acid

There total 10 articles about 3-{4-[4-(1H-benzoimidazol-2-ylamino)-piperidin-1-yl]-benzoylamino}-2-(4-nitro-benzenesulfonylamino)-propionic acid 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:

: 247033-99-4
2-(1-{4-[2-tert-butoxycarbonyl-2-(4-nitro-benzenesulfonylamino)-ethylcarbamoyl]-phenyl}-piperidin-4-ylamino)-benzoimidazole-1-carboxylic acid tert-butyl ester

: 247034-00-0
3-{4-[4-(1H-benzoimidazol-2-ylamino)-piperidin-1-yl]-benzoylamino}-2-(4-nitro-benzenesulfonylamino)-propionic acid

Guidance literature:: With trifluoroacetic acid; In dichloromethane; at 20 ℃; for 2h;
DOI:10.1016/j.bmc.2005.10.061

Reference yield:

: 247035-03-6
4-{4-(1H-benzimidazol-2-ylamino)piperidin-1-yl}benzoic acid

: 247034-00-0
3-{4-[4-(1H-benzoimidazol-2-ylamino)-piperidin-1-yl]-benzoylamino}-2-(4-nitro-benzenesulfonylamino)-propionic acid

Guidance literature:: Multi-step reaction with 5 steps

1: 77 percent / 1-hydroxybenzotriazole hydrate; N-methylmorpholine; 1-(3-dimethylaminopropyl)-3-ethylcarbodiimide hydrochloride / dimethylformamide / 13 h

2: 100 percent / Et₃N / CH₂Cl₂ / 1 h / 20 °C

3: 64 percent / AcOH; H₂ / Pd/C / tetrahydrofuran; H₂O / 14 h / 20 °C

4: (i-Pr)2NEt / dimethylformamide / 1.5 h / 20 °C

5: 15.1 mg / CF₃CO₂H / CH₂Cl₂ / 2 h / 20 °C

With 4-methyl-morpholine; hydrogen; acetic acid; 1-hydroxybenzotriazol-hydrate; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; N-ethyl-N,N-diisopropylamine; trifluoroacetic acid; palladium on activated charcoal; In tetrahydrofuran; dichloromethane; water; N,N-dimethyl-formamide;
DOI:10.1016/j.bmc.2005.10.061

Reference yield:

: 247035-02-5
ethyl 4-{4-(1H-benzimidazol-2-ylamino)piperidin-1-yl}benzoate

: 247034-00-0
3-{4-[4-(1H-benzoimidazol-2-ylamino)-piperidin-1-yl]-benzoylamino}-2-(4-nitro-benzenesulfonylamino)-propionic acid

Guidance literature:: Multi-step reaction with 6 steps

1: 97 percent / NaOH / methanol; tetrahydrofuran; H₂O / 3 h / 40 °C

2: 77 percent / 1-hydroxybenzotriazole hydrate; N-methylmorpholine; 1-(3-dimethylaminopropyl)-3-ethylcarbodiimide hydrochloride / dimethylformamide / 13 h

3: 100 percent / Et₃N / CH₂Cl₂ / 1 h / 20 °C

4: 64 percent / AcOH; H₂ / Pd/C / tetrahydrofuran; H₂O / 14 h / 20 °C

5: (i-Pr)2NEt / dimethylformamide / 1.5 h / 20 °C

6: 15.1 mg / CF₃CO₂H / CH₂Cl₂ / 2 h / 20 °C

With 4-methyl-morpholine; sodium hydroxide; hydrogen; acetic acid; 1-hydroxybenzotriazol-hydrate; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; N-ethyl-N,N-diisopropylamine; trifluoroacetic acid; palladium on activated charcoal; In tetrahydrofuran; methanol; dichloromethane; water; N,N-dimethyl-formamide;
DOI:10.1016/j.bmc.2005.10.061