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1H-Pyrrolo[2,3-b]pyridine, 5-fluoro-1-[(4-methylphenyl)sulfonyl]- is a chemical with a specific purpose. Lookchem provides you with multiple data and supplier information of this chemical.

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  • 866318-99-2 Structure
  • Basic information

    1. Product Name: 1H-Pyrrolo[2,3-b]pyridine, 5-fluoro-1-[(4-methylphenyl)sulfonyl]-
    2. Synonyms: 1H-Pyrrolo[2,3-b]pyridine, 5-fluoro-1-[(4-methylphenyl)sulfonyl]-;5-fluoro-1-tosyl-1H-pyrrolo [2,3-b]pyridine;5-fluoro-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine
    3. CAS NO:866318-99-2
    4. Molecular Formula: C14H11FN2O2S
    5. Molecular Weight: 290.31
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 866318-99-2.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 473.2°C at 760 mmHg
    3. Flash Point: 240°C
    4. Appearance: /
    5. Density: 1.38g/cm3
    6. Vapor Pressure: 4.02E-09mmHg at 25°C
    7. Refractive Index: 1.641
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 1H-Pyrrolo[2,3-b]pyridine, 5-fluoro-1-[(4-methylphenyl)sulfonyl]-(CAS DataBase Reference)
    11. NIST Chemistry Reference: 1H-Pyrrolo[2,3-b]pyridine, 5-fluoro-1-[(4-methylphenyl)sulfonyl]-(866318-99-2)
    12. EPA Substance Registry System: 1H-Pyrrolo[2,3-b]pyridine, 5-fluoro-1-[(4-methylphenyl)sulfonyl]-(866318-99-2)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 866318-99-2(Hazardous Substances Data)

866318-99-2 Usage

Chemical structure

1H-Pyrrolo[2,3-b]pyridine derivative
A compound based on a pyrrolopyridine core structure, which is a fusion of a pyrrole and a pyridine ring.

Substituent

5-fluoro-1-[(4-methylphenyl)sulfonyl]
A functional group attached to the core structure, consisting of a fluorine atom at the 5-position, a sulfonyl group connected to a 4-methylphenyl ring, and an additional carbon atom.

Potential applications

Medicinal chemistry and drug discovery
The compound has diverse biological activities, making it a promising candidate for the development of new drugs and therapies.

Pharmacological property modification

5-fluoro-1-[(4-methylphenyl)sulfonyl] group
The presence of this group allows for the optimization of the compound's pharmacological properties, making it suitable for various therapeutic applications.

Specific uses and effects

Context-dependent and require further research
The exact applications and effects of the compound will depend on the specific context in which it is used and the results of additional research and development.

Check Digit Verification of cas no

The CAS Registry Mumber 866318-99-2 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 8,6,6,3,1 and 8 respectively; the second part has 2 digits, 9 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 866318-99:
(8*8)+(7*6)+(6*6)+(5*3)+(4*1)+(3*8)+(2*9)+(1*9)=212
212 % 10 = 2
So 866318-99-2 is a valid CAS Registry Number.
InChI:InChI=1/C14H11FN2O2S/c1-10-2-4-13(5-3-10)20(18,19)17-7-6-11-8-12(15)9-16-14(11)17/h2-9H,1H3

866318-99-2SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name 1H-Pyrrolo[2,3-b]pyridine, 5-fluoro-1-[(4-methylphenyl)sulfonyl]-

1.2 Other means of identification

Product number -
Other names 5-fluoro-1-(5-hydroxymethyl-tetrahydro-furan-2-yl)-1H-pyrimidine-2,4-dione

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:866318-99-2 SDS

866318-99-2Relevant articles and documents

FORMULATIONS OF AZAINDOLE COMPOUNDS

-

, (2021/01/22)

The present invention relates to pharmaceutical compositions, each comprising a multitude of granules that make up an intragranular phase of the composition, wherein the granules are produced by fluid bed granulation and comprise a HCI salt of Compound (1

METHODS OF PREPARING INHIBITORS OF INFLUENZA VIRUSES REPLICATION

-

, (2016/12/01)

A method of preparing a compound of Formula (I) or a pharmaceutically acceptable salt thereof comprises: (a) reacting Compound (1) or (b) a pharmaceutically acceptable salt thereof with Compound (2) in the presence of water, an organic solvent, a base, an

METHODS OF PREPARING INHIBITORS OF INFLUENZA VIRUSES REPLICATION

-

, (2015/06/03)

A method of preparing Compound (1) or a pharmaceutically acceptable salt thereof: comprises: (a) reacting Compound (X): a pharmaceutically acceptable salt thereof with Compound (Y): in the presence of a palladium catalyst and a carbonate or phosphate base

INHIBITORS OF INFLUENZA VIRUSES REPLICATION

-

, (2015/06/03)

Polymorphic forms of Compound (1) or a pharmaceutically acceptable salt thereof, wherein Compound (1) is represented by the following structural formula: are Form A of HCl salt of Compound (1)·1/2Η20, Form F of HCl salt of Compound (1)·3Η2

Discovery of VX-509 (Decernotinib): A Potent and Selective Janus Kinase 3 Inhibitor for the Treatment of Autoimmune Diseases

Farmer, Luc J.,Ledeboer, Mark W.,Hoock, Thomas,Arnost, Michael J.,Bethiel, Randy S.,Bennani, Youssef L.,Black, James J.,Brummel, Christopher L.,Chakilam, Ananthsrinivas,Dorsch, Warren A.,Fan, Bin,Cochran, John E.,Halas, Summer,Harrington, Edmund M.,Hogan, James K.,Howe, David,Huang, Hui,Jacobs, Dylan H.,Laitinen, Leena M.,Liao, Shengkai,Mahajan, Sudipta,Marone, Valerie,Martinez-Botella, Gabriel,McCarthy, Pamela,Messersmith, David,Namchuk, Mark,Oh, Luke,Penney, Marina S.,Pierce, Albert C.,Raybuck, Scott A.,Rugg, Arthur,Salituro, Francesco G.,Saxena, Kumkum,Shannon, Dean,Shlyakter, Dina,Swenson, Lora,Tian, Shi-Kai,Town, Christopher,Wang, Jian,Wang, Tiansheng,Wannamaker, M. Woods,Winquist, Raymond J.,Zuccola, Harmon J.

, p. 7195 - 7216 (2015/10/05)

While several therapeutic options exist, the need for more effective, safe, and convenient treatment for a variety of autoimmune diseases persists. Targeting the Janus tyrosine kinases (JAKs), which play essential roles in cell signaling responses and can contribute to aberrant immune function associated with disease, has emerged as a novel and attractive approach for the development of new autoimmune disease therapies. We screened our compound library against JAK3, a key signaling kinase in immune cells, and identified multiple scaffolds showing good inhibitory activity for this kinase. A particular scaffold of interest, the 1H-pyrrolo[2,3-b]pyridine series (7-azaindoles), was selected for further optimization in part on the basis of binding affinity (Ki) as well as on the basis of cellular potency. Optimization of this chemical series led to the identification of VX-509 (decernotinib), a novel, potent, and selective JAK3 inhibitor, which demonstrates good efficacy in vivo in the rat host versus graft model (HvG). On the basis of these findings, it appears that VX-509 offers potential for the treatment of a variety of autoimmune diseases.

Design of potent IGF1-R inhibitors related to bis-azaindoles

Nemecek, Conception,Metz, William A.,Wentzler, Sylvie,Ding, Fa-Xiang,Venot, Corinne,Souaille, Catherine,Dagallier, Anne,Maignan, Sebastien,Guilloteau, Jean-Pierre,Bernard, Francois,Henry, Alain,Grapinet, Sandrine,Lesuisse, Dominique

scheme or table, p. 100 - 106 (2011/03/19)

From an azaindole lead, identified in high throughput screen, a series of potent bis-azaindole inhibitors of IGF1-R have been synthesized using rational drug design and SAR based on a in silico binding mode hypothesis. Although the resulting compounds produced the expected improved potency, the model was not validated by the co-crystallization experiments with IGF1-R.

Novel Bis-Azaindole Derivatives, Preparation And Pharmaceutical Use Thereof As Kinase Inhibitors

-

Page/Page column 31, (2010/11/30)

Disclosed are compounds of formula (I): wherein R1, R2, R3, R4, and R5 have the meanings given in the description, and to salts thereof, pharmaceutical compositions comprising said compounds and the use thereof as protein kinase inhibitors.

Novel pyrrolo (2,3-b)pyridine derivatives, the preparation and the pharmaceutical use thereof in the form of kinase inhibitors

-

Page/Page column 44, (2008/06/13)

Novel compounds of formula (I): or pharmaceutically acceptable salts thereof, wherein R, R1, R2, R3, R4, R5, and R6 have the meanings given in the description, pharmaceutical compositions comprising said compounds and use thereof as protein kinase inhibit

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