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4-[(6-methylsulfanylpurin-9-yl)methyl]benzenesulfonamide

4-[(6-methylsulfanylpurin-9-yl)methyl]benzenesulfonamide structure

CAS No:
21268-01-9
Formula:
C13H13N5O2S2
Chemical Name:
4-[(6-methylsulfanylpurin-9-yl)methyl]benzenesulfonamide
Synonyms:
21268-01-9;p-Toluenesulfonamide, alpha-[6-(methylthio)-9H-purin-9-yl]-;.alpha.-[[6-Methylthio]-9H-purine-9-yl]-p-toluenesulfonamide;NSC109844;4-{[6-(methylsulfanyl)-9h-purin-9-yl]methyl}benzenesulfonamide;DTXSID20296544;Benzenesulfonamide,4-[[6-(methylthio)-9H-purin-9-yl]methyl]-;NSC-109844;DS-010246;4-((6-(Methylthio)-9H-purin-9-yl)methyl)benzenesulfonamide;4-([6-(Methylsulfanyl)-9H-purin-9-yl]methyl)benzenesulfonamide #

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4-[(6-methylsulfanylpurin-9-yl)methyl]benzenesulfonamide Basic Attributes

Molecular Weight：

335.4 g/mol

Exact Mass：

335.05106702 g/mol

NSC Number：

109844

DSSTox ID：

DTXSID20296544

Characteristics

PSA：

137 Å²

Computed Properties

Molecular Weight:335.4
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:335.05106702
Monoisotopic Mass:335.05106702
Topological Polar Surface Area:137
Heavy Atom Count:22
Complexity:475
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-[(6-methylsulfanylpurin-9-yl)methyl]benzenesulfonamide

Basic Attributes
Characteristics
Computed Properties

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