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6-(pyridin-4-ylmethylsulfanyl)-3,7-dihydropurin-2-one

6-(pyridin-4-ylmethylsulfanyl)-3,7-dihydropurin-2-one structure

CAS No:
646510-99-8
Formula:
C11H9N5OS
Chemical Name:
6-(pyridin-4-ylmethylsulfanyl)-3,7-dihydropurin-2-one
Synonyms:
AC1L9XUG;646510-99-8;DTXSID00333027;6-(4-Benzylthiopyridine)2-hydroxypurine;6-(4-pyridylmethylsulfanyl)-9H-purin-2-ol

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6-(pyridin-4-ylmethylsulfanyl)-3,7-dihydropurin-2-one Basic Attributes

Molecular Weight：

259.29 g/mol

Exact Mass：

259.05278110 g/mol

DSSTox ID：

DTXSID00333027

Characteristics

PSA：

108 Å²

Computed Properties

Molecular Weight:259.29
XLogP3:1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:259.05278110
Monoisotopic Mass:259.05278110
Topological Polar Surface Area:108
Heavy Atom Count:18
Complexity:355
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-(pyridin-4-ylmethylsulfanyl)-3,7-dihydropurin-2-one

Basic Attributes
Characteristics
Computed Properties

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