N-(3-chloroquinoxalin-2-yl)-4-methylbenzenesulfonamide

Base Information

• Chemical Name: N-(3-chloroquinoxalin-2-yl)-4-methylbenzenesulfonamide
• CAS No.: 4029-41-8
• Molecular Formula: C15H12ClN3O2S
• Molecular Weight: 333.798
• Hs Code.: 2935009090
• DSSTox Substance ID: DTXSID20350392
• Wikidata: Q82126311
• ChEMBL ID: CHEMBL1518476
• Mol file: 4029-41-8.mol

Synonyms:N-(3-chloroquinoxalin-2-yl)-4-methylbenzenesulfonamide;4029-41-8;N-(3-Chloro-quinoxalin-2-yl)-4-methyl-benzenesulfonamide;C15H12ClN3O2S;N-(3-chloroquinoxalin-2-yl)-4-methylbenzene-1-sulfonamide;MLS-0090835.0001;N-(3-chloro-2-quinoxalinyl)-4-methylbenzenesulfonamide;Oprea1_205179;cid_677919;SCHEMBL2302031;CHEMBL1518476;BDBM45850;DTXSID20350392;MFCD00501967;STL468857;AKOS000115728;DS-14315;CS-0153038;EN300-02019;C75042;AF-962/02749006;n-(3-chloroquinoxalin-2-yl)-4-methylphenylsulfonamide;F2158-2236;n-(3-chloroquinoxalin-2-yl)-4-methyl-benzenesulfonamide;N-(3-chloranylquinoxalin-2-yl)-4-methyl-benzenesulfonamide

Chemical Property of N-(3-chloroquinoxalin-2-yl)-4-methylbenzenesulfonamide

Chemical Property:

• Vapor Pressure: 5.85E-10mmHg at 25°C
• Refractive Index: 1.686
• Boiling Point: 495.5 °C at 760 mmHg
• Flash Point: 253.5 °C
• PSA: 80.33000
• Density: 1.468 g/cm³
• LogP: 4.54620
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 333.0338755
• Heavy Atom Count: 22
• Complexity: 474

Purity/Quality:

99% ^*data from raw suppliers

N-(3-Chloroquinoxalin-2-yl)-4-methylbenzenesulfonamide 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2Cl
• Uses: N-(3-Chloroquinoxalin-2-yl)-4-methylbenzenesulfonamide is used as a reactant in the preparation of pyrazine derivatives as PI3K inhibitors, useful in treatment and prophylaxis of diseases.

Technology Process of N-(3-chloroquinoxalin-2-yl)-4-methylbenzenesulfonamide

There total 1 articles about N-(3-chloroquinoxalin-2-yl)-4-methylbenzenesulfonamide 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: 95.0%

2,3-dichloroquinoxaline (2213-63-0) + toluene-4-sulfonamide (70-55-3) → N-(3-chloro-quinoxalin-2-yl)-toluene-4-sulfonamide (4029-41-8)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; for 1h; Heating;

DOI:10.1007/BF01165702

Reference yield: 91.0%

N-(3-chloro-quinoxalin-2-yl)-toluene-4-sulfonamide (4029-41-8) + methyl iodide (74-88-4) → N-(3-Chloro-quinoxalin-2-yl)-4,N-dimethyl-benzenesulfonamide

Guidance literature:

With potassium carbonate; In dimethyl sulfoxide; at 40 ℃; for 6h;

DOI:10.1007/BF01165702

Reference yield: 90.0%

4-methoxy-aniline (104-94-9) + N-(3-chloro-quinoxalin-2-yl)-toluene-4-sulfonamide (4029-41-8) → N-[3-(4-Methoxy-phenylamino)-quinoxalin-2-yl]-4-methyl-benzenesulfonamide

Guidance literature:

In N,N-dimethyl-formamide; Heating;

DOI:10.1007/BF01165702

upstream raw materials:

2,3-dichloroquinoxaline

toluene-4-sulfonamide

Downstream raw materials:

12-n-quinoxalino<2,3-b>-<1,4>benzoxazine

N-[3-(2-Chloro-5-trifluoromethyl-phenylamino)-quinoxalin-2-yl]-4-methyl-benzenesulfonamide

N-{3-[(2-naphthyl)methoxy]quinoxalin-2-yl}-4-toluene-sulfonamide

Refernces