Compound ID | 2450

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Dioxonaphthoimidazolium 32

Class: Small molecule antibacterial agent

Agent Type: Synthetic; Small molecule; Direct acting;
Spectrum of activity: Antimycobacterial
Mechanism of action: Interacts with mycobacterial respiratory chain and generates reactive oxygen species
Target Pathogen: Active against Mycobacterium sp.;
Description: Synthetic compound; analogues reported; selectivity index >25 (IC50 for mammalian cells/MIC50); shows synergistic effect with isoniazid
Institute where first reported: Department of Pharmacy, National University of Singapore, 117543 Singapore
Year first mentioned: 2021
Development status: Experimental
Chemical structure(s):
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Molecular weight: 381.53
Iso. SMILES: CCCCCCCC[N+]1=C(N(C2=C1C(=O)C3=CC=CC=C3C2=O)CCCC)C
InChI Key: BJVTXYXHGMWQPU-UHFFFAOYSA-N
Can. SMILES: CCCCCCCC[N+]1=C(C)N(CCCC)C2=C1C(=O)C3=C(C=CC=C3)C2=O
InChI: InChI=1S/C24H33N2O2/c1-4-6-8-9-10-13-17-26-18(3)25(16-7-5-2)21-22(26)24(28)20-15-12-11-14-19(20)23(21)27/h11-12,14-15H,4-10,13,16-17H2,1-3H3/q+1
External links:
PubChem link: https://pubchem.ncbi.nlm.nih.gov/compound/163198547
Citation: https://pubs.acs.org/doi/10.1021/acs.jmedchem.1c01383

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