Home Nitriles 9H-Indeno[1,2-b]pyrazine-2,3-dicarbonitrile, 9-oxo-

9H-Indeno[1,2-b]pyrazine-2,3-dicarbonitrile, 9-oxo-

CAS No.:
40114-84-9
Catalog Number:
AG00C6E3
Molecular Formula:
C13H4N4O
Molecular Weight:
232.1971
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Product Description
Catalog Number:
AG00C6E3
Chemical Name:
9H-Indeno[1,2-b]pyrazine-2,3-dicarbonitrile, 9-oxo-
CAS Number:
40114-84-9
Molecular Formula:
C13H4N4O
Molecular Weight:
232.1971
MDL Number:
MFCD03042397
IUPAC Name:
9-oxoindeno[1,2-b]pyrazine-2,3-dicarbonitrile
InChI:
InChI=1S/C13H4N4O/c14-5-9-10(6-15)17-12-11(16-9)7-3-1-2-4-8(7)13(12)18/h1-4H
InChI Key:
HUWWIHVYVDAXCT-UHFFFAOYSA-N
SMILES:
N#Cc1nc2c3ccccc3C(=O)c2nc1C#N
NSC Number:
159143
Properties
Complexity:
470  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.039g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.202g/mol
Monoisotopic Mass:
232.039g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
90.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
Pharmacological targets in the ubiquitin system offer new ways of treating cancer, neurodegenerative disorders and infectious diseases. Expert reviews in molecular medicine 20111101
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Synthesis and biological evaluation of 9-oxo-9H-indeno[1,2-b]pyrazine-2,3-dicarbonitrile analogues as potential inhibitors of deubiquitinating enzymes. ChemMedChem 20100406
Properties