3-Amino-4-(4-fluorophenyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylic acid

Base Information

Chemical Name:3-Amino-4-(4-fluorophenyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylic acid
CAS No.:94655-71-7
Molecular Formula:C20H13FN2O2S
Molecular Weight:364.39300
Hs Code.:
DSSTox Substance ID:DTXSID701326917
ChEMBL ID:CHEMBL1545714
Mol file:94655-71-7.mol

Synonyms:3-amino-4-(4-fluorophenyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylic acid;94655-71-7;Oprea1_147881;MLS000777560;CHEMBL1545714;SCHEMBL16583614;DTXSID701326917;HMS2773P18;STL336041;AKOS003677827;SMR000413954;3-Amino-4-(4-fluoro-phenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid

Suppliers and Price of 3-Amino-4-(4-fluorophenyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 3-Amino-4-(4-fluorophenyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylic acid

Chemical Property:

Melting Point:195 - 196 °C (dioxane)
Boiling Point:631.3±55.0 °C(Predicted)
PKA:3.00±0.30(Predicted)
PSA：104.45000
Density:1.424±0.06 g/cm3(Predicted)
LogP:5.63100
XLogP3:5.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:364.06817700
Heavy Atom Count:26
Complexity:508

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C(C=C1)C2=NC3=C(C(=C2)C4=CC=C(C=C4)F)C(=C(S3)C(=O)O)N

Technology Process of 3-Amino-4-(4-fluorophenyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylic acid

There total 2 articles about 3-Amino-4-(4-fluorophenyl)-6-phenylthieno[2,3-b]pyridine-2-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: 93.0%

: 94640-05-8
[3-Cyano-4-(4-fluoro-phenyl)-6-phenyl-pyridin-2-ylsulfanyl]-acetic acid

: 94655-71-7
3-Amino-4-(4-fluoro-phenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid

Guidance literature:: With sodium ethanolate; In ethanol; for 4.5h; Heating;

Reference yield:

: 89451-46-7
6-phenyl-4-(4-fluorophenyl)-3-cyano-2(1H)-pyridinethione

: 94655-71-7
3-Amino-4-(4-fluoro-phenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid

Guidance literature:: Multi-step reaction with 2 steps

1: 98 percent / 10percent aq. KOH / dimethylformamide / 1.5 h / Ambient temperature

2: 93 percent / EtONa / ethanol / 4.5 h / Heating

With potassium hydroxide; sodium ethanolate; In ethanol; N,N-dimethyl-formamide;