Novel Indole‐Linked 1,2,3‐Triazole Analogues: Synthesis, Anti‐Tubercular Screening, and Molecular Docking Analysis
ABSTRACT The design and synthesis of novel indole‐linked 1,2,3‐triazole hybrids targeting Mycobacterium tuberculosis (H37Rv). The methods are summarized, highlighting the use of CuAAC reactions for synthesis and characterization via HRMS, NMR, and in vitro anti‐tubercular screening. Key results emphasize the potent activity of para ‐nitro and cyano‐substituted compounds (MIC = 1.56–3.125 μg/mL), comparable to ethambutol, supported by molecular docking studies revealing strong binding interactions with MtbAT protein. The significance of these findings is underscored by their potential to address drug‐resistant TB, with ADMET profiles suggesting promising drug‐like properties.
Authors
- Nagaraju Kerru (ORCID: https://orcid.org/0000-0002-5354-9545)
- Ravikumar Kapavarapu (ORCID: https://orcid.org/0000-0002-6466-8005)
- Mani Sandeep Kumar Mylapalli (ORCID: https://orcid.org/0000-0002-1085-6086)
- Suprapaneni Sirisha
- Suresh Maddila (ORCID: https://orcid.org/0000-0001-5183-2104)
- Sandeep Kumar Thoota
- V. Prasannakumar
Institutions
- SRM University, Andhra Pradesh (IN)
- GITAM University (IN)
- University of KwaZulu-Natal (ZA)
Publication Details
- Journal
- Journal of Heterocyclic Chemistry
- Published
- 2025-09-03
- DOI
- https://doi.org/10.1002/jhet.70083
- Primary Topic
- Click Chemistry and Applications
- Type
- article
- Field-Weighted Citation Impact
- 0.00