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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)-

ethyl 5H-pyrimido[4,5-b][1,4]thiazine-6-carboxylate

CCOC(=O)C1=CSc2c(N1)cncn2 Request for Quotation
Chemical Name: ethyl 5H-pyrimido[4,5-b][1,4]thiazine-6-carboxylate
CAS Number: 69785-97-3
Product Number: AG005TMU(AGN-PC-0NJ0ZA)
Synonyms:
MDL No:
Molecular Formula: C9H9N3O2S
Molecular Weight: 223.2517

Identification/Properties

Properties
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
223.25g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
223.042g/mol
Monoisotopic Mass:
223.042g/mol
Topological Polar Surface Area:
89.4A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
283
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


Ethyl 5H-pyrimido[4,5-b][1,4]thiazine-6-carboxylate is a versatile compound widely used in chemical synthesis for the preparation of heterocyclic derivatives. This compound serves as a valuable building block in the construction of diverse molecular structures due to its unique reactivity and ability to participate in various synthetic transformations.One of the key applications of Ethyl 5H-pyrimido[4,5-b][1,4]thiazine-6-carboxylate in chemical synthesis is its role as a precursor in the synthesis of biologically active compounds. By incorporating this compound into synthetic routes, chemists can access a range of potent pharmaceuticals, agrochemicals, and materials with tailored properties and activities. Furthermore, the functional groups present in Ethyl 5H-pyrimido[4,5-b][1,4]thiazine-6-carboxylate enable further derivatization, allowing for the introduction of additional functionalities to create novel molecular scaffolds.Additionally, Ethyl 5H-pyrimido[4,5-b][1,4]thiazine-6-carboxylate can be utilized in the formation of heterocycles through various cyclization reactions, such as condensation, oxidation, and reduction processes. These reactions lead to the formation of complex ring systems, which are essential structural motifs in natural products and drug molecules. The presence of the pyrimidine, thiazine, and ester moieties in this compound provides a platform for the synthesis of diverse heterocyclic frameworks with potential biological significance.In summary, Ethyl 5H-pyrimido[4,5-b][1,4]thiazine-6-carboxylate plays a crucial role in chemical synthesis by serving as a versatile building block for the construction of biologically active compounds and diverse heterocyclic structures. Its reactivity and flexibility make it a valuable tool for the design and development of novel molecules with desired properties and applications in various fields of chemistry.