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8-(butylsulfanyl)-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione

8-(butylsulfanyl)-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione structure

CAS No:
303973-49-1
Formula:
C18H22N4O2S
Chemical Name:
8-(butylsulfanyl)-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Synonyms:
8-(butylsulfanyl)-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione;ZINC2060835;STK806232;AKOS000717443;MCULE-1139630872;UPCMLD0ENAT5731860:001;ST50241264;AG-690/12244874;8-butylthio-3-methyl-7-[(3-methylphenyl)methyl]-1,3,7-trihydropurine-2,6-dione

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8-(butylsulfanyl)-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione Basic Attributes

Molecular Weight：

358.45788

Exact Mass：

358.146

Characteristics

PSA：

92.5

XLogP3：

3.4

Computed Properties

Molecular Weight:358.5
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:358.14634713
Monoisotopic Mass:358.14634713
Topological Polar Surface Area:92.5
Heavy Atom Count:25
Complexity:504
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 8-(butylsulfanyl)-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione

Basic Attributes
Characteristics
Computed Properties

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