8-butylsulfanyl-3,7-dihydropurine-2,6-dione
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8-butylsulfanyl-3,7-dihydropurine-2,6-dione
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CAS No:
73840-28-5
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Formula:
C9H12N4O2S
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Chemical Name:
8-butylsulfanyl-3,7-dihydropurine-2,6-dione
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Synonyms:
8-(Butylthio)xanthine;Xanthine, 8-(butylthio)-;UNII-1OU4QPQ7KJ;1OU4QPQ7KJ;73840-28-5;NSC 81501;8-butylsulfanyl-3,7-dihydropurine-2,6-dione;NCIOpen2_004355;DTXSID90994969;NSC81501;ZINC1574519;NSC-81501;WLN: T56 BM DN FMVMVJ CS4;8-(Butylsulfanyl)-9H-purine-2,6-diol;1H-Purine-2, 8-(butylthio)-3,7-dihydro-;8-(Butylthio)-1H-purine-2,6(3H,7H)-dione;1H-Purine-2,6-dione, 8-(butylthio)-3,7-dihydro- (9CI)
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CAS No:
8-butylsulfanyl-3,7-dihydropurine-2,6-dione Basic Attributes
240.28 g/mol
240.06809681 g/mol
1OU4QPQ7KJ
81501
Computed Properties
Molecular Weight:240.28
XLogP3:1.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:240.06809681
Monoisotopic Mass:240.06809681
Topological Polar Surface Area:112
Heavy Atom Count:16
Complexity:299
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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