2-Phenylthiazolo[3,2-a]quinolin-10-ium-1-olate

Base Information

• Chemical Name: 2-Phenylthiazolo[3,2-a]quinolin-10-ium-1-olate
• CAS No.: 43091-21-0
• Molecular Formula: C₁₇H₁₁NOS
• Molecular Weight: 277.346
• NSC Number: 303525
• DSSTox Substance ID: DTXSID20355387
• Wikidata: Q82134253
• ChEMBL ID: CHEMBL297669

Synonyms:43091-21-0;2-PHENYL-10??-[1,3]THIAZOLO[3,2-A]QUINOLIN-10-YLIUM-1-OLATE;ST50563768;CHEMBL297669;DTXSID20355387;NSC303525;STK922078;AKOS004897052;NSC-303525;NCGC00326813-01;AB01321424-02;AB01321424-03;2-phenylthiazolo[3,2-a]quinolin-10-ium-1-olate

Chemical Property of 2-Phenylthiazolo[3,2-a]quinolin-10-ium-1-olate

Chemical Property:

• Vapor Pressure: 3.6E-10mmHg at 25°C
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 277.05613515
• Heavy Atom Count: 20
• Complexity: 523

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

2-PHENYL(1,3)THIAZOLO(3,2-A)QUINOLIN-10-IUM-1-OLATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=S=C3C=CC4=CC=CC=C4N3C2=O

Technology Process of 2-Phenylthiazolo[3,2-a]quinolin-10-ium-1-olate

There total 3 articles about 2-Phenylthiazolo[3,2-a]quinolin-10-ium-1-olate 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:

α-chlorophenylacetyl chloride (2912-62-1) + Quinoline-2-thiol (2637-37-8) → 1-oxo-2-phenyl-1,2-dihydro-thiazolo[3,2-a]quinolinylium betaine (43091-21-0)

Guidance literature:

DOI:10.1021/jm00149a023

Reference yield:

1H-quinoline-2-thione + 2-bromophenylacetic acid (4870-65-9,31302-84-8) → 1-oxo-2-phenyl-1,2-dihydro-thiazolo[3,2-a]quinolinylium betaine (43091-21-0)

Guidance literature:

Multistep reaction; (i) aq. NaHCO₃, (ii) Py, Ac₂O;

Reference yield:

→ 1-oxo-2-phenyl-1,2-dihydro-thiazolo[3,2-a]quinolinylium betaine (43091-21-0)

Guidance literature:

2-mercapto-quinoline, PhBrCH-COCl;

DOI:10.1021/jo00407a032

upstream raw materials:

2-bromophenylacetic acid

α-chlorophenylacetyl chloride

Quinoline-2-thiol

Downstream raw materials:

2-(2-Chinolinylthio)-5,6,7,8-tetrachlor-2-phenyl-2,3-dihydrobenzodioxin-3-on

1,4-Bis(benzolsulfonyl)-2-(2-chinolinylthio)-6,7-dimethyl-2-phenyl-1,2,3,4-tetrahydrochinoxalin-3-on

6,7-Dimethyl-3-phenyl-1,2-dihydro-chinoxalin-2-on

1-Benzolsulfonyl-6,7-dimethyl-3-phenyl-1,2-dihydrochinoxalin-2-on

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