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8-benzylsulfanyl-7H-purine

8-benzylsulfanyl-7H-purine structure

CAS No:
13516-51-3
Formula:
C12H10N4S
Chemical Name:
8-benzylsulfanyl-7H-purine
Synonyms:
8-benzylsulfanyl-7H-purine;MLS000736988;13516-51-3;SMR000393946;NSC38845;8-(benzylthio)-7H-purine;8-(Benzylthio)-9H-purine;Oprea1_049614;cid_236401;8-(phenylmethylthio)-7H-purine;CHEMBL1526917;SCHEMBL11356169;BDBM61844;DTXSID40284766;HMS2750F24;8-(phenylmethylsulfanyl)-7H-purine;NSC-38845;ZINC13597273

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8-benzylsulfanyl-7H-purine Basic Attributes

Molecular Weight：

242.30 g/mol

Exact Mass：

242.06261751 g/mol

NSC Number：

38845

DSSTox ID：

DTXSID40284766

Characteristics

PSA：

79.8 Å²

Computed Properties

Molecular Weight:242.30
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:242.06261751
Monoisotopic Mass:242.06261751
Topological Polar Surface Area:79.8
Heavy Atom Count:17
Complexity:245
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 8-benzylsulfanyl-7H-purine

Basic Attributes
Characteristics
Computed Properties

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