Compound ID | 2934

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Compound 6f (2-(4-(3-((6-chloro-1-isopropyl-1H-benzo[d]imidazol-2-yl)amino)-2-hydroxypropoxy)phenyl)acetonitrile)

Class: Antivirulence agent

Agent Type: Synthetic; Small molecule; Indirect acting; Antivirulence;
Spectrum of activity: Gram-negative
Mechanism of action: Inhibits production of pyocyanin and 2-alkyl-4(1H)-quinolones/ PqsR inhibitor
Target Pathogen: Active against Pseudomonas aeruginosa
Description: Synthetic compound; cytotoxicity to epithelial and carcinoma cell lines observed only at >100 uM
Year first mentioned: 2024
Development status: Experimental
Chemical structure(s):
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Molecular weight: 398.89
Iso. SMILES: CC(C)N1C2=C(C=CC(=C2)Cl)N=C1NCC(COC3=CC=C(C=C3)CC#N)O
InChI Key: SYDWHCIVWIRKCC-UHFFFAOYSA-N
Can. SMILES: CC(C)N1C2=C(C=CC(=C2)Cl)N=C1NCC(COC3=CC=C(C=C3)CC#N)O
InChI: InChI=1S/C21H23ClN4O2/c1-14(2)26-20-11-16(22)5-8-19(20)25-21(26)24-12-17(27)13-28-18-6-3-15(4-7-18)9-10-23/h3-8,11,14,17,27H,9,12-13H2,1-2H3,(H,24,25)
External links:
PubChem link: https://pubchem.ncbi.nlm.nih.gov/compound/170453229
Citation: https://pubs.acs.org/doi/10.1021/acs.jmedchem.3c00973

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