2-[2-amino-6-[(4-methylphenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymet hyl)oxolane-3,4-diol
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![2-[2-amino-6-[(4-methylphenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymet hyl)oxolane-3,4-diol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/4ab754cf9f254db7b4e89fdb6b14e975.png "2-[2-amino-6-[(4-methylphenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymet hyl)oxolane-3,4-diol")
2-[2-amino-6-[(4-methylphenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymet hyl)oxolane-3,4-diol
structure -
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CAS No:
93996-50-0
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Formula:
C18H21N5O4S
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Chemical Name:
2-[2-amino-6-[(4-methylphenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymet hyl)oxolane-3,4-diol
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Synonyms:
NSC48717;DTXSID90287045;NSC-48717;6-{[(4-Methylphenyl)methyl]sulfanyl}-9-pentofuranosyl-9H-purin-2-amine
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CAS No:
2-[2-amino-6-[(4-methylphenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymet hyl)oxolane-3,4-diol Basic Attributes
403.457
403.131
48717
DTXSID90287045
Computed Properties
Molecular Weight:403.5
XLogP3:1.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:403.13142534
Monoisotopic Mass:403.13142534
Topological Polar Surface Area:165
Heavy Atom Count:28
Complexity:526
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
2-[2-amino-6-[(4-methylphenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymet hyl)oxolane-3,4-diol
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