1-(Benzenesulfonyl)-2-(2-nitrophenyl)-1H-indole

Base Information

• Chemical Name: 1-(Benzenesulfonyl)-2-(2-nitrophenyl)-1H-indole
• CAS No.: 88207-42-5
• Molecular Formula: C20H14N2O4S
• Molecular Weight: 378.408
• DSSTox Substance ID: DTXSID00527848
• Wikidata: Q82397068
• Mol file: 88207-42-5.mol

Synonyms:1-(Benzenesulfonyl)-2-(2-nitrophenyl)-1H-indole;88207-42-5;DTXSID00527848

Chemical Property of 1-(Benzenesulfonyl)-2-(2-nitrophenyl)-1H-indole

Chemical Property:

• XLogP3: 4.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 378.06742811
• Heavy Atom Count: 27
• Complexity: 635

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3C=C2C4=CC=CC=C4[N+](=O)[O-]

Technology Process of 1-(Benzenesulfonyl)-2-(2-nitrophenyl)-1H-indole

There total 3 articles about 1-(Benzenesulfonyl)-2-(2-nitrophenyl)-1H-indole 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: 88.0%

2-nitrophenyl bromide (577-19-5) + 2-(trimethylstannyl)-N-(benzenesulfonyl)indole → 2-(2-nitrophenyl)-1-phenylsulphonylindole (88207-42-5)

Guidance literature:

With copper(l) iodide; tetrakis(triphenylphosphine) palladium⁽⁰⁾; at 100 ℃; for 16h;

DOI:10.1016/j.tet.2008.09.101

Reference yield: 55.0%

2-nitrophenyl bromide (577-19-5) + 1-benzenesulfonyl-2-tri-n-butylstannyl-1H-indole → 2-(2-nitrophenyl)-1-phenylsulphonylindole (88207-42-5)

Guidance literature:

With bis-triphenylphosphine-palladium(II) chloride; In N,N-dimethyl-formamide; at 110 ℃; for 5h;

Reference yield:

2-(2-nitrophenyl)-1H-indole (59050-53-2) + benzenesulfonyl chloride (98-09-9) → 2-(2-nitrophenyl)-1-phenylsulphonylindole (88207-42-5)

Guidance literature:

With sodium hydroxide; tetra(n-butyl)ammonium hydroxide; In tetrahydrofuran; water; for 1h;

upstream raw materials:

2-(2-nitrophenyl)-1H-indole

benzenesulfonyl chloride

2-nitrophenyl bromide

Downstream raw materials:

2-(2-nitrophenyl)-1H-indole

2-(2-benzamidophenyl)-1-phenylsulphonylindole

N-[2-(1H-indol-2-yl)phenyl]benzamide

2-(2-aminophenyl)-1-phenylsulphonylindole