Compound ID | 3632

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Triazolopyrimidine compound 33

Synonym(s): 7-(5-Methylfuran-2-yl)-N-(4-(trifluoromethyl) phenethyl)-[1,2,4]triazolo[4,3-a]pyrimidin-5-amine

Class: Small molecule antibacterial agent

Agent Type: Synthetic; Small molecule; Direct acting;
Spectrum of activity: Antimycobacterial
Mechanism of action: Targets aerobic respiration; QcrB inhibitor
Target Pathogen: Active against Mycobacterium tuberculosis
Description: Synthetic compound; has >270 selectivity index (MIC vs HepG2 CC50)
Institute where first reported: Center for Global Infectious Disease Research, Seattle Children’s Research Institute, Seattle, Washington, United States
Year first mentioned: 2025
Development status: Experimental
Chemical structure(s):
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Molecular weight: 387.36
Iso. SMILES: CC(O1)=CC=C1C2=NC3=NN=CN3C(NCCC4=CC=C(C(F)(F)F)C=C4)=C2
InChI Key: YXRAZWFVNHVBGD-UHFFFAOYSA-N
Can. SMILES: CC1=CC=C(C2=NC3=NN=CN3C(=C2)NCCC4=CC=C(C=C4)C(F)(F)F)O1
InChI: InChI=1S/C19H16F3N5O/c1-12-2-7-16(28-12)15-10-17(27-11-24-26-18(27)25-15)23-9-8-13-3-5-14(6-4-13)19(20,21)22/h2-7,10-11,23H,8-9H2,1H3
External links:
Structure link: https://pubchem.ncbi.nlm.nih.gov/compound/176516509
Guide to Pharmacology: compound 33 [PMID: 40529071]
Citation: https://pubs.acs.org/doi/10.1021/acsmedchemlett.5c00073

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