9-butyl-6-(3-methyl-5-nitroimidazol-4-yl)sulfanylpurin-2-amine
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9-butyl-6-(3-methyl-5-nitroimidazol-4-yl)sulfanylpurin-2-amine
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CAS No:
36892-45-2
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Formula:
C13H16N8O2S
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Chemical Name:
9-butyl-6-(3-methyl-5-nitroimidazol-4-yl)sulfanylpurin-2-amine
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Synonyms:
MLS002667130;36892-45-2;NSC47781;CHEMBL1888474;DTXSID00286807;HMS3087K04;ZINC1679431;NSC-47781;SMR001556902;9-Butyl-6-((1-methyl-4-nitro-1H-imidazol-5-yl)thio)-9H-purin-2-amine
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CAS No:
9-butyl-6-(3-methyl-5-nitroimidazol-4-yl)sulfanylpurin-2-amine Basic Attributes
348.39 g/mol
348.11169296 g/mol
47781
DTXSID00286807
Computed Properties
Molecular Weight:348.39
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:348.11169296
Monoisotopic Mass:348.11169296
Topological Polar Surface Area:159
Heavy Atom Count:24
Complexity:452
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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