1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine

Base Information

• Chemical Name: 1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine
• CAS No.: 143141-23-5
• Molecular Formula: C13H10N2O2S
• Molecular Weight: 258.301
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID20357361
• Nikkaji Number: J3.465.466B
• Wikidata: Q82137249
• ChEMBL ID: CHEMBL1465782
• Mol file: 143141-23-5.mol

Synonyms:143141-23-5;1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine;1-(benzenesulfonyl)pyrrolo[2,3-b]pyridine;1-(Phenylsulfonyl)-7-azaindole;1-(benzenesulfonyl)-1H-pyrrolo[2,3-b]pyridine;1H-PYRROLO[2,3-B]PYRIDINE, 1-(PHENYLSULFONYL)-;MFCD02083292;1-Benzenesulfonyl-1H-pyrrolo[2,3-b]pyridine;N-Phenylsulfonyl-7-azaindole;MLS000539720;Bionet2_000473;Oprea1_668212;1-phenylsulfonyl-7-azaindole;SCHEMBL1773294;CHEMBL1465782;1-(benzenesulfonyl)-7-azaindole;DTXSID20357361;KEPQQULYWDIKEK-UHFFFAOYSA-N;HMS1365F11;HMS2298O20;CS-B0532;N-BENZENESULFONYL-7-AZAINDOLE;AKOS015840619;CCG-277911;DS-0311;PB17262;11P-322S;N-Benzenesulfonyl-pyrrolo[2,3-b]pyridine;SMR000162577;SY024584;AM20061823;FT-0645597;1H-Pyrrolo[2,3-b]pyridine,1-(phenylsulfonyl)-;A808023;W-205586

Chemical Property of 1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine

Chemical Property:

• Boiling Point: 465.8 °C at 760 mmHg
• Flash Point: 235.5 °C
• PSA: 60.34000
• Density: 1.34 g/cm³
• LogP: 3.35410
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 258.04629874
• Heavy Atom Count: 18
• Complexity: 384

Purity/Quality:

97% ^*data from raw suppliers

1-(Benzenesulfonyl)pyrrolo[2,3-b]pyridine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2N=CC=C3

Technology Process of 1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine

There total 2 articles about 1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine 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: 99.0%

7-Azaindole (271-63-6) + benzenesulfonyl chloride (98-09-9) → 1-benzenesulfonyl-1H-pyrrolo[2,3-b]pyridine (143141-23-5)

Guidance literature:

7-Azaindole; With tetrabutylammomium bromide; sodium hydroxide; In dichloromethane;

benzenesulfonyl chloride; In dichloromethane; at 0 - 20 ℃;

DOI:10.1016/j.ejmech.2015.12.023

Reference yield:

7-Azaindole (271-63-6) → 1-benzenesulfonyl-1H-pyrrolo[2,3-b]pyridine (143141-23-5)

Guidance literature:

With NaH; benzenesulfonyl chloride; In tetrahydrofuran; water;

Reference yield: 96.0%

1-benzenesulfonyl-1H-pyrrolo[2,3-b]pyridine (143141-23-5) + methyl iodide (74-88-4) → 1-benzenesulfonyl-2-methyl-1H-pyrrolo[2,3-b]pyridine (189089-83-6)

Guidance literature:

1-benzenesulfonyl-1H-pyrrolo[2,3-b]pyridine; With lithium diisopropyl amide; In tetrahydrofuran; at -30 ℃; for 0.666667h;

methyl iodide; In tetrahydrofuran; at 20 ℃; for 3h;

DOI:10.1021/jo0358168

upstream raw materials:

7-Azaindole

benzenesulfonyl chloride

Downstream raw materials:

2-benzenesulfonylamino-nicotinic acid

(1-Benzenesulfonyl-1H-pyrrolo[2,3-b]pyridin-2-yl)-thiophen-2-yl-methanol

1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine-2-carbaldehyde

1-(phenyl-sulfonyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid