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14003-34-0 | 2(1H)-Quinoxalinone, 3-methyl-
CAS No: 14003-34-0 Catalog No: AG001BYT MDL No:MFCD00047567
Product Description
Catalog Number:
AG001BYT
Chemical Name:
2(1H)-Quinoxalinone, 3-methyl-
CAS Number:
14003-34-0
Molecular Formula:
C9H8N2O
Molecular Weight:
160.1726
MDL Number:
MFCD00047567
IUPAC Name:
3-methyl-1H-quinoxalin-2-one
InChI:
InChI=1S/C9H8N2O/c1-6-9(12)11-8-5-3-2-4-7(8)10-6/h2-5H,1H3,(H,11,12)
InChI Key:
BMIMNRPAEPIYDN-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2ccccc2nc1C
EC Number:
237-807-4
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.064g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
160.176g/mol
Monoisotopic Mass:
160.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Literature
| Title | Journal |
|---|---|
| N'-(3-Methyl-quinoxalin-2-yl)-N'-phenyl-benzohydrazide. | Acta crystallographica. Section E, Structure reports online 20110601 |
| 3-[2-(3-Methyl-quinoxalin-2-yl-oxy)eth-yl]-1,3-oxazolidin-2-one. | Acta crystallographica. Section E, Structure reports online 20100501 |
| 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 |
| Structure-activity studies of substituted quinoxalinones as multiple-drug-resistance antagonists. | Journal of medicinal chemistry 20010215 |
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