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Home Other Building Blocks 2-ACETYL-3-METHYLQUINOXALINEDIIUM-1,4-DIOLATE

2-ACETYL-3-METHYLQUINOXALINEDIIUM-1,4-DIOLATE

CAS No.:
13297-17-1
Catalog Number:
AG009BCS
Molecular Formula:
C11H10N2O3
Molecular Weight:
218.2087
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Product Description
Catalog Number:
AG009BCS
Chemical Name:
2-ACETYL-3-METHYLQUINOXALINEDIIUM-1,4-DIOLATE
CAS Number:
13297-17-1
Molecular Formula:
C11H10N2O3
Molecular Weight:
218.2087
MDL Number:
MFCD00113235
IUPAC Name:
1-(3-methyl-4-oxido-1-oxoquinoxalin-1-ium-2-yl)ethanone
InChI:
InChI=1S/C11H10N2O3/c1-7-11(8(2)14)13(16)10-6-4-3-5-9(10)12(7)15/h3-6H,1-2H3
InChI Key:
CUJMCPPBTUATEJ-UHFFFAOYSA-N
SMILES:
CC(=O)c1[n+]([O-])c2ccccc2[n+](c1C)[O-]
NSC Number:
720472
Properties
Complexity:
375  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.069g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.212g/mol
Monoisotopic Mass:
218.069g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Literature
Title Journal
E-2-[3-(3,4-dichlorophenyl)-1-oxo-2-propenyl]-3-methylquinoxaline-1,4-dioxide: a lead antitubercular agent which alters mitochondrial respiration in rat liver. European journal of medicinal chemistry 20101001
2-(3-Aryl-2-propenoyl)-3-methylquinoxaline-1,4-dioxides: a novel cluster of tumor-specific cytotoxins which reverse multidrug resistance. Bioorganic & medicinal chemistry 20090601
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Synthesis of new 2-acetyl and 2-benzoyl quinoxaline 1,4-di-N-oxide derivatives as anti-Mycobacterium tuberculosis agents. European journal of medicinal chemistry 20030901
Properties