1H-Purine-2,6-dione, 3,7-dihydro-7-methyl-1,3-dipropyl-


Chemical Name: 1H-Purine-2,6-dione, 3,7-dihydro-7-methyl-1,3-dipropyl-
CAS Number: 31542-63-9
Product Number: AG00BXBR(AGN-PC-0JPN95)
Synonyms:
MDL No:
Molecular Formula: C12H18N4O2
Molecular Weight: 250.2969

Identification/Properties


Computed Properties
Molecular Weight:
250.302g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
250.143g/mol
Monoisotopic Mass:
250.143g/mol
Topological Polar Surface Area:
58.4A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
347
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



7-Methyl-1,3-dipropyl-1H-purine-2,6(3H,7H)-dione, often referred to as $name$, is a versatile compound widely utilized in chemical synthesis due to its unique properties. As a heterocyclic compound, $name$ plays a crucial role in the creation of various organic molecules through different synthetic pathways.One of the key applications of $name$ in chemical synthesis is as a starting material for the synthesis of novel purine derivatives. By serving as a key building block, $name$ enables the introduction of specific functional groups, such as alkyl or aryl substituents, onto the purine scaffold. This diversification of the purine structure opens up a myriad of possibilities for creating new compounds with potential biological activities or pharmacological properties.Furthermore, the presence of the methyl and propyl groups in $name$ allows for precise control over the stereochemistry and regiochemistry of the products formed during chemical reactions. This level of control is crucial in designing and synthesizing complex molecules with high purity and specificity.In summary, the strategic incorporation of 7-Methyl-1,3-dipropyl-1H-purine-2,6(3H,7H)-dione in chemical synthesis enables researchers to access a wide range of functionalized purine derivatives with tailored properties, making it a valuable tool in the field of organic chemistry.