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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

4(1H)-Quinazolinone, 5-bromo-

Brc1cccc2c1c(=O)[nH]cn2 Request for Quotation
Chemical Name: 4(1H)-Quinazolinone, 5-bromo-
CAS Number: 147006-47-1
Product Number: AG001EIU(AGN-PC-02MCUJ)
Synonyms:
MDL No: MFCD09954863
Molecular Formula: C8H5BrN2O
Molecular Weight: 225.0421

Identification/Properties

Properties
BP:
430.2°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
225.045g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
223.959g/mol
Monoisotopic Mass:
223.959g/mol
Topological Polar Surface Area:
41.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
229
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


5-Bromo-4(3H)-quinazolinone is a versatile intermediate that plays a crucial role in chemical synthesis, particularly in the field of medicinal and organic chemistry. Its unique structure and reactivity make it a valuable building block for the synthesis of various bioactive compounds and pharmaceuticals.One significant application of 5-Bromo-4(3H)-quinazolinone is in the development of potential drug candidates. By functionalizing the bromo group and modifying the quinazolinone core, chemists can create novel molecules with enhanced biological activities. These derivatives can target specific enzymes, receptors, or pathways, potentially leading to the discovery of new therapeutic agents for various diseases.Furthermore, 5-Bromo-4(3H)-quinazolinone can also be used in the synthesis of fluorescent dyes and imaging agents. Its inherent fluorescence properties make it a valuable precursor for labeling biomolecules and studying cellular processes. Chemists can attach different fluorophores to the quinazolinone scaffold, allowing for the visualization and tracking of specific molecules in biological systems.In summary, the versatile nature of 5-Bromo-4(3H)-quinazolinone makes it an essential building block in chemical synthesis, particularly in the design and development of bioactive compounds, pharmaceuticals, fluorescent probes, and other innovative molecules for various scientific applications.