2-[2-amino-6-(2-phenylethylsulfanyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
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2-[2-amino-6-(2-phenylethylsulfanyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
structure -
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CAS No:
13153-21-4
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Formula:
C18H21N5O4S
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Chemical Name:
2-[2-amino-6-(2-phenylethylsulfanyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
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Synonyms:
13153-21-4;NSC46392;DTXSID90927252;NSC-46392;9-Pentofuranosyl-6-[(2-phenylethyl)sulfanyl]-3,9-dihydro-2H-purin-2-imine
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CAS No:
2-[2-amino-6-(2-phenylethylsulfanyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Basic Attributes
403.5 g/mol
403.13142534 g/mol
46392
Computed Properties
Molecular Weight:403.5
XLogP3:1.8
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:6
Exact Mass:403.13142534
Monoisotopic Mass:403.13142534
Topological Polar Surface Area:165
Heavy Atom Count:28
Complexity:514
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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