Methyl 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carbiMidate

Base Information

• Chemical Name: Methyl 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carbiMidate
• CAS No.: 304874-06-4
• Molecular Formula: C15H13FN4O
• Molecular Weight: 284.293
• UNII: 6M4NBD2F8W
• Nikkaji Number: J1.500.684F
• Mol file: 304874-06-4.mol

Synonyms:304874-06-4;Methyl 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carbiMidate;methyl 1-[(2-fluorophenyl)methyl]pyrazolo[3,4-b]pyridine-3-carboximidate;Riociguat Impurity 2;6M4NBD2F8W;C15H13FN4O;SCHEMBL5476235;WSKGRWHECMNHBT-UHFFFAOYSA-N;F11955;methyl (2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carboximidate;Methyl1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carbiMidate;Methyl (2-fluorobenzyl)-1H-pyrazolo[3, 4-b]pyridine-3-carboximidate;Methyl 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carbox-imidate;Methyl 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carboximidate;1H-Pyrazolo[3,4-b]pyridine-3-carboximidic acid, 1-[(2-fluorophenyl)methyl]-, methyl ester;Methyl 1-[(2-fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridine-3-carboximidate

Chemical Property of Methyl 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carbiMidate

Chemical Property:

• PSA: 63.79000
• LogP: 2.69020
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 284.10733921
• Heavy Atom Count: 21
• Complexity: 381

Purity/Quality:

98%Min ^*data from raw suppliers

Methyl1-[(2-Fluorophenyl)methyl]pyrazolo[3,4-b]pyridine-3-carboximidate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=N)C1=NN(C2=C1C=CC=N2)CC3=CC=CC=C3F
• Uses: Methyl 1-[(2-Fluorophenyl)methyl]pyrazolo[3,4-b]pyridine-3-carboximidate is a useful reactant to study metabolites of orally active NO-independent pyrazolopyridine stimulators of soluble guanylate cyclase.

Technology Process of Methyl 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carbiMidate

There total 14 articles about Methyl 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carbiMidate 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: 100.0%

sodium methylate (124-41-4) + 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carbonitrile (256376-65-5) → methyl 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carbimidate (304874-06-4)

Guidance literature:

In methanol; at 20 ℃; for 2h;

DOI:10.1016/S0968-0896(02)00034-2

Reference yield: 100.0%

methanol (67-56-1) + 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carbonitrile (256376-65-5) → methyl 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carbimidate (304874-06-4)

Guidance literature:

With sodium methylate; at 20 ℃; for 2h;

DOI:10.1016/S0960-894X(01)00073-7

Reference yield:

1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carbonitrile (256376-65-5) → methyl 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carbimidate (304874-06-4)

Guidance literature:

With sodium methylate; In methanol;

upstream raw materials:

methanol

1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carbonitrile

sodium methylate

(2-fluorobenzyl)hydrazine

Downstream raw materials:

2-(1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)pyrimidine-4,5,6- triamine

ethyl 4-amino-2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]pyrimidine-5-carboxylate

2-({4,6-diamino-2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]pyrimidin-5-yl}amino)ethanol

2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-[(E)-phenyldiazen-1-yl]pyrimidine-4,6-diamine