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2226086-65-1

2226086-65-1 Structure

2226086-65-1 Structure
IdentificationBack Directory
[Name]

2-Pyrazinecarboxamide, 3-amino-N-(aminoiminomethyl)-6-(2-benzofuranyl)-5-(hexahydro-1H-azepin-1-yl)-
[CAS]

2226086-65-1
[Synonyms]

2-Pyrazinecarboxamide, 3-amino-N-(aminoiminomethyl)-6-(2-benzofuranyl)-5-(hexahydro-1H-azepin-1-yl)-
[Molecular Formula]

C20H23N7O2
[MOL File]

2226086-65-1.mol
[Molecular Weight]

393.44
Chemical PropertiesBack Directory
[density ]

1.51±0.1 g/cm3(Predicted)
[solubility ]

DMSO: 2 mg/mL, clear
[form ]

Solid
[pka]

9.60±0.46(Predicted)
[color ]

Light yellow to yellow
[SMILES]

NC(NC(C1=NC(C2=CC(C=CC=C3)=C3O2)=C(N4CCCCCC4)N=C1N)=O)=N
Hazard InformationBack Directory
[Uses]

BB2-50F is a potent and multi-targeting bioenergetic bactericidal inhibitor of M. tuberculosis and can sterilizes replicating and non-replicating M. tuberculosis. BB2-50F inhibits succinate oxidation, decreases the activity of the tricarboxylic acid (TCA) cycle, and results in succinate secretion from M. tuberculosis.[1]
[References]

[1] Adolph C, et al. A dual-targeting succinate dehydrogenase and F1Fo-ATP synthase inhibitor rapidly sterilizes replicating and non-replicating Mycobacterium tuberculosis. Cell Chem Biol. 2023 Dec 21:S2451-9456(23)00432-4. DOI:10.1016/j.chembiol.2023.12.002
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