Home Other Building Blocks 2H-1,4-Benzoxazin-3(4H)-one

2H-1,4-Benzoxazin-3(4H)-one

CAS No.:
5466-88-6
Catalog Number:
AG003HCT
Molecular Formula:
C8H7NO2
Molecular Weight:
149.1467
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$15
- +
25g
98%
In Stock USA
United States
$44
- +
100g
98%
In Stock USA
United States
$132
- +
500g
98%
In Stock USA
United States
$619
- +
Product Description
Catalog Number:
AG003HCT
Chemical Name:
2H-1,4-Benzoxazin-3(4H)-one
CAS Number:
5466-88-6
Molecular Formula:
C8H7NO2
Molecular Weight:
149.1467
MDL Number:
MFCD00158536
IUPAC Name:
4H-1,4-benzoxazin-3-one
InChI:
InChI=1S/C8H7NO2/c10-8-5-11-7-4-2-1-3-6(7)9-8/h1-4H,5H2,(H,9,10)
InChI Key:
QRCGFTXRXYMJOS-UHFFFAOYSA-N
SMILES:
O=C1COc2c(N1)cccc2
UNII:
Q0QAF5G662
NSC Number:
26354
Properties
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.048g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
149.149g/mol
Monoisotopic Mass:
149.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Literature
Title Journal
In silico characterization of three two-component systems of Ehrlichia canis and evaluation of a natural plant-derived inhibitor. Genetics and molecular research : GMR 20121004
Synthesis of 2H-benzo[b][1,4]oxazin-3(4H)-one derivatives as platelet aggregation inhibitors. Bioorganic & medicinal chemistry letters 20120101
Synthesis and pharmacological evaluations of novel 2H-benzo[b][1,4]oxazin-3(4H)-one derivatives as a new class of anti-cancer agents. European journal of medicinal chemistry 20111001
Structure-activity relationship of benzoxazinones and related compounds with respect to the growth inhibition and alpha-amylase activity in cress seedlings. Journal of plant physiology 20101015
Fluconazole analogues containing 2H-1,4-benzothiazin-3(4H)-one or 2H-1,4-benzoxazin-3(4H)-one moieties, a novel class of anti-Candida agents. Bioorganic & medicinal chemistry letters 20100115
Aromatic-ring-functionalised benzoxazinones in the system Oryza sativa-Echinochloa crus-galli as biorational herbicide models. Pest management science 20091001
Rediscovering the bioactivity and ecological role of 1,4-benzoxazinones. Natural product reports 20090401
Synthesis of novel 1,4-benzoxazin-3-one derivatives as inhibitors against tyrosine kinases. Bioorganic & medicinal chemistry 20090115
Synthesis of novel 7-benzylamino-2H-1,4-benzoxazin-3(4H)-ones as anticonvulsant agents. European journal of medicinal chemistry 20080601
Novel potent and selective thrombin inhibitors based on a central 1,4-benzoxazin-3(4H)-one scaffold. Journal of medicinal chemistry 20080508
Study on bioactive compounds from Streptomyces sp. ANU 6277. Polish journal of microbiology 20080101
Bad housekeeping: why do aphids leave their exuviae inside the colony? BMC evolutionary biology 20080101
Benzofused tricycles based on 2-quinoxalinol. Journal of combinatorial chemistry 20070101
Isolation and synthesis of allelochemicals from gramineae: benzoxazinones and related compounds. Journal of agricultural and food chemistry 20060222
Toward a novel class of antithrombotic compounds with dual function. Discovery of 1,4-benzoxazin-3(4H)-one derivatives possessing thrombin inhibitory and fibrinogen receptor antagonistic activities. Journal of medicinal chemistry 20050505
Design and synthesis of novel platelet fibrinogen receptor antagonists with 2H-1,4-benzoxazine-3(4H)-one scaffold. A systematic study. European journal of medicinal chemistry 20050101
Chemical basis for the antifeedant activity of natural hydroxamic acids and related compounds. Journal of agricultural and food chemistry 20040505
Utilisation of electrospray time-of-flight mass spectrometry for solving complex fragmentation patterns: application to benzoxazinone derivatives. Journal of mass spectrometry : JMS 20031001
Antitumor agents. Part 218: Cappamensin A, a new In vitro anticancer principle, from Capparis sikkimensis. Bioorganic & medicinal chemistry letters 20030707
Development of a liquid chromatography-electrospray-tandem mass spectrometry method for the quantitative determination of benzoxazinone derivatives in plants. Analytical chemistry 20030701
Effects of 1,4-benzoxazin-3-one derivatives from maize on survival and fecundity of Metopolophium dirhodum (Walker) on artificial diet. Journal of chemical ecology 20010201
Properties