1-{3-[(7H-Purin-6-yl)sulfanyl]propyl}pyrimidine-2,4(1H,3H)-dione

Base Information

• Chemical Name: 1-{3-[(7H-Purin-6-yl)sulfanyl]propyl}pyrimidine-2,4(1H,3H)-dione
• CAS No.: 80900-21-6
• Molecular Formula: C₁₂H₁₂N₆O₂S
• Molecular Weight: 304.332
• DSSTox Substance ID: DTXSID60521589
• Wikidata: Q82386147

Synonyms:80900-21-6;DTXSID60521589;1-{3-[(7H-Purin-6-yl)sulfanyl]propyl}pyrimidine-2,4(1H,3H)-dione

Chemical Property of 1-{3-[(7H-Purin-6-yl)sulfanyl]propyl}pyrimidine-2,4(1H,3H)-dione

Chemical Property:

• XLogP3: 0.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 304.07424482
• Heavy Atom Count: 21
• Complexity: 446

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CN(C(=O)NC1=O)CCCSC2=NC=NC3=C2NC=N3

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