8-(butylsulfanyl)-7-dodecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
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8-(butylsulfanyl)-7-dodecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
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CAS No:
316361-73-6
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Formula:
C22H38N4O2S
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Chemical Name:
8-(butylsulfanyl)-7-dodecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
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Synonyms:
8-(butylsulfanyl)-7-dodecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione;ZINC8425688;STK700402;AKOS000717668;MCULE-9611263398;ST50239097;AG-690/11972381;Z239546998;8-butylthio-7-dodecyl-3-methyl-1,3,7-trihydropurine-2,6-dione;8-(butylsulfanyl)-7-dodecyl-3-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
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CAS No:
8-(butylsulfanyl)-7-dodecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione Basic Attributes
422.62772
422.272
Computed Properties
Molecular Weight:422.6
XLogP3:7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:15
Exact Mass:422.27154764
Monoisotopic Mass:422.27154764
Topological Polar Surface Area:92.5
Heavy Atom Count:29
Complexity:505
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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