1-benzyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid

Base Information

• Chemical Name: 1-benzyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid
• CAS No.: 929975-85-9
• Molecular Formula: C₁₄H₁₁N₃O₂
• Molecular Weight: 253.26
• European Community (EC) Number: 839-523-1
• Mol file: 929975-85-9.mol

Synonyms:1-benzyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid;929975-85-9;1-benzylpyrazolo[3,4-b]pyridine-5-carboxylic acid;AKOS009117892;CCG-339572;CS-0243989;EN300-27064;G27152;1-benzyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylicacid;Z235333737

Chemical Property of 1-benzyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid

Chemical Property:

• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 253.085126602
• Heavy Atom Count: 19
• Complexity: 331

Purity/Quality:

99% ^*data from raw suppliers

1-Benzyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CN2C3=NC=C(C=C3C=N2)C(=O)O

Technology Process of 1-benzyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid

There total 2 articles about 1-benzyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic 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: 90.0%

benzyl 1-benzyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate → 1-benzyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid (929975-85-9)

Guidance literature:

With lithium hydroxide; In tetrahydrofuran; methanol; water; at 20 ℃; for 8h; Inert atmosphere;

DOI:10.1002/anie.201507266

Reference yield:

C17H17N5O2 (949321-55-5) → 1-benzyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid (929975-85-9)

Guidance literature:

With hydrogenchloride; water; acetic acid; for 4h; Reflux;

DOI:10.1055/s-0029-1216798

Reference yield: 78.0%

1-benzyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid (929975-85-9) + 4-aminomethyl-[2,4']bioxazole → N-([2,4']bioxazol-4-yl)methyl 1-benzyl-1H-pyrazolo[3,4-b]pyridine-5-carboxamide

Guidance literature:

With 4-methyl-morpholine; O-(benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate; In N,N-dimethyl-formamide; at 0 - 20 ℃; for 18.5h; Inert atmosphere;

DOI:10.1002/anie.201507266

upstream raw materials:

C₁₇H₁₇N₅O₂

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