CAS 730992-64-0

3-Butyl-8-(chloromethyl)-3,7-dihydro-7-propyl-1H-purine-2,6-dione

Description:

3-Butyl-8-(chloromethyl)-3,7-dihydro-7-propyl-1H-purine-2,6-dione is a purine derivative characterized by its complex structure, which includes a purine ring system substituted with various functional groups. The presence of a butyl group and a chloromethyl group contributes to its hydrophobic and reactive properties, respectively. This compound is likely to exhibit biological activity, potentially interacting with various biological targets due to its purine core, which is a fundamental component of nucleotides and nucleic acids. The chloromethyl group may serve as a site for further chemical modifications or reactions, enhancing its utility in medicinal chemistry or as a synthetic intermediate. Additionally, the compound's solubility and stability can be influenced by the substituents on the purine ring, which may affect its pharmacokinetic properties. Overall, 3-Butyl-8-(chloromethyl)-3,7-dihydro-7-propyl-1H-purine-2,6-dione represents a structurally interesting molecule with potential applications in drug development and biochemistry.

Formula: C₁₃H₁₉ClN₄O₂

InChI: InChI=1S/C13H19ClN4O2/c1-3-5-7-18-11-10(12(19)16-13(18)20)17(6-4-2)9(8-14)15-11/h3-8H2,1-2H3,(H,16,19,20)

InChI key: InChIKey=LIGCQQYVLYWBEK-UHFFFAOYSA-N

SMILES: C(CC)N1C2=C(N(CCCC)C(=O)NC2=O)N=C1CCl

Synonyms:

• 3-Butyl-8-(chloromethyl)-3,7-dihydro-7-propyl-1H-purine-2,6-dione
• 1H-Purine-2,6-dione, 3-butyl-8-(chloromethyl)-3,7-dihydro-7-propyl-