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Structure of 426842-85-5

Chemical Structure| 426842-85-5

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Product Citations

Product Citations

Lu, Yanran ; Vibhute, Sandip ; Li, Linsen ; Okumu, Antony ; Ratigan, Steven C. ; Nolan, Sheri , et al.

Abstract: Novel bacterial topoisomerase inhibitors (NBTIs) are among the most promising new antibiotics in preclin./clin. development. We previously reported dioxane-linked NBTIs with potent antistaphylococcal activity and reduced hERG inhibition, a key safety liability. Herein, polarity-focused optimization enabled the delineation of clear structure-property relationships for both microsomal metabolic stability and hERG inhibition, resulting in the identification of lead compound 79 (I). This mol. demonstrates potent antibacterial activity against diverse Gram-pos. pathogens, inhibition of both DNA gyrase and topoisomerase IV, a low frequency of resistance, a favorable in vitro cardiovascular safety profile, and in vivo efficacy in a murine model of methicillin-resistant Staphylococcus aureus infection.

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Product Details of [ 426842-85-5 ]

CAS No. :426842-85-5
Formula : C10H8FNO
M.W : 177.18
SMILES Code : COC1=CC=C2N=CC(F)=CC2=C1
MDL No. :MFCD12400834
InChI Key :LEJRFUDTXRWNFQ-UHFFFAOYSA-N
Pubchem ID :11309840

Safety of [ 426842-85-5 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P305+P351+P338
 

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