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1176405-02-9

4,5,6,7-Tetrahydro-5-azaindole, also known as THAIA, is a chemical compound characterized by its bicyclic heterocycle structure, which includes a pyrrole and a piperidine ring. As a derivative of the indole molecule, THAIA serves as a fundamental building block in the synthesis of a variety of pharmaceuticals and fine chemicals. Its potential pharmacological properties, such as antimicrobial and antifungal activities, position THAIA as a promising intermediate in the development of novel drug candidates. 4,5,6,7-Tetrahydro-5-azaindole's structural versatility and synthetic accessibility have also attracted the attention of organic and medicinal chemists, who utilize it in the design and synthesis of biologically active compounds.

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  • 1176405-02-9 Structure

  • Basic information

    1. Product Name: 4,5,6,7-Tetrahydro-5-azaindole
    2. Synonyms: 4,5,6,7-Tetrahydro-5-azaindole;4,5,6,7-Tetrahydro-1H-pyrrolo[3,2-c]pyridine
    3. CAS NO:1176405-02-9
    4. Molecular Formula: C7H10N2
    5. Molecular Weight: 122.1677
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 1176405-02-9.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 286.0±30.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.104±0.06 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: 2-8°C(protect from light)
    8. Solubility: N/A
    9. PKA: 17.85±0.20(Predicted)
    10. CAS DataBase Reference: 4,5,6,7-Tetrahydro-5-azaindole(CAS DataBase Reference)
    11. NIST Chemistry Reference: 4,5,6,7-Tetrahydro-5-azaindole(1176405-02-9)
    12. EPA Substance Registry System: 4,5,6,7-Tetrahydro-5-azaindole(1176405-02-9)

  • 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: 1176405-02-9(Hazardous Substances Data)

1176405-02-9 Usage

Uses

Used in Pharmaceutical Synthesis:
4,5,6,7-Tetrahydro-5-azaindole is used as a key intermediate in the synthesis of pharmaceuticals for its ability to contribute to the development of new drug candidates with potential therapeutic applications.
Used in Organic Chemistry:
THAIA is utilized as a versatile building block in organic chemistry, allowing for the creation of a wide range of biologically active compounds due to its structural flexibility and ease of synthesis.
Used in Medicinal Chemistry:
In the field of medicinal chemistry, 4,5,6,7-Tetrahydro-5-azaindole is employed as a valuable component in the design of compounds with specific pharmacological properties, such as antimicrobial and antifungal activities, which are crucial for addressing various medical needs.
Used in Antimicrobial and Antifungal Agents Development:
4,5,6,7-Tetrahydro-5-azaindole is used as a precursor in the development of antimicrobial and antifungal agents, leveraging its inherent bioactivity to combat a range of microbial infections.

Check Digit Verification of cas no

The CAS Registry Mumber 1176405-02-9 includes 10 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 7 digits, 1,1,7,6,4,0 and 5 respectively; the second part has 2 digits, 0 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 1176405-02:
(9*1)+(8*1)+(7*7)+(6*6)+(5*4)+(4*0)+(3*5)+(2*0)+(1*2)=139
139 % 10 = 9
So 1176405-02-9 is a valid CAS Registry Number.

1176405-02-9SDS

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[3,?2-?c]?pyridine, 4,?5,?6,?7-?tetrahydro-

1.2 Other means of identification

Product number -
Other names -

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:1176405-02-9 SDS

1176405-02-9Downstream Products

1176405-02-9Relevant articles and documents

Discovery of novel indolinone-based, potent, selective and brain penetrant inhibitors of LRRK2

Troxler, Thomas,Greenidge, Paulette,Zimmermann, Kaspar,Desrayaud, Sandrine,Drückes, Peter,Schweizer, Tatjana,Stauffer, Daniela,Rovelli, Giorgio,Shimshek, Derya R.

, p. 4085 - 4090 (2013/07/25)

Mutations in leucine-rich repeat kinase-2 (LRRK2) are the most common genetic cause of Parkinson's disease (PD). The most frequent kinase-enhancing mutation is the G2019S residing in the kinase activation domain. This opens up a promising therapeutic avenue for drug discovery targeting the kinase activity of LRRK2 in PD. Several LRRK2 inhibitors have been reported to date. Here, we report a selective, brain penetrant LRRK2 inhibitor and demonstrate by a competition pulldown assay in vivo target engagement in mice.

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