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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)-

2H-Purin-2-one, 1,3,6,7-tetrahydro-6-thioxo-

O=c1[nH]c(=S)c2c([nH]1)[nH]cn2 Request for Quotation
Chemical Name: 2H-Purin-2-one, 1,3,6,7-tetrahydro-6-thioxo-
CAS Number: 2002-59-7
Product Number: AG002CM1(AGN-PC-0K2UIA)
Synonyms:
MDL No:
Molecular Formula: C5H4N4OS
Molecular Weight: 168.1765

Identification/Properties

Computed Properties
Molecular Weight:
168.174g/mol
XLogP3:
-0.1
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
168.011g/mol
Monoisotopic Mass:
168.011g/mol
Topological Polar Surface Area:
102A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
219
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

NMR Spectrum

Other Analytical Data

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Chemical Structure


6-Thioxo-1,3,6,9-tetrahydro-2H-purin-2-one, also known as $name$, is a versatile compound widely utilized in chemical synthesis. Its unique structure and properties make it a valuable building block in the creation of various pharmaceuticals, agrochemicals, and organic compounds.In chemical synthesis, $name$ serves as a key intermediate for the production of purine-based derivatives. Purines are essential components in DNA, RNA, and various biochemical processes, making them crucial for life. By incorporating $name$ into synthetic pathways, chemists can access a diverse range of purine analogs with potential biological activities.Moreover, the reactive thioxo group in $name$ offers opportunities for further functionalization, allowing chemists to introduce additional chemical moieties and tailor the molecule's properties for specific applications. This flexibility makes $name$ a valuable tool for designing novel compounds with enhanced pharmacological or agricultural properties.Overall, the application of 6-Thioxo-1,3,6,9-tetrahydro-2H-purin-2-one in chemical synthesis highlights its importance as a versatile building block in the development of biologically active compounds and functional materials.