9-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]-3H-purine-6-thione

Base Information

• Chemical Name: 9-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]-3H-purine-6-thione
• CAS No.: 91368-19-3
• Molecular Formula: C12H10N8S2
• NSC Number: 98757
• DSSTox Substance ID: DTXSID90394506

Synonyms:91368-19-3;9-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]-3H-purine-6-thione;NSC98757;DTXSID90394506;NSC-98757;9,9'-(Ethane-1,2-diyl)di(3,9-dihydro-6H-purine-6-thione)

Chemical Property of 9-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]-3H-purine-6-thione

Chemical Property:

• XLogP3: -0.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 330.04698470
• Heavy Atom Count: 22
• Complexity: 501

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=NC(=S)C2=C(N1)N(C=N2)CCN3C=NC4=C3NC=NC4=S

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