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8-cyclohexylsulfanyl-1,3-dimethyl-7H-purine-2,6-dione

8-cyclohexylsulfanyl-1,3-dimethyl-7H-purine-2,6-dione structure

CAS No:
6466-37-1
Formula:
C13H18N4O2S
Chemical Name:
8-cyclohexylsulfanyl-1,3-dimethyl-7H-purine-2,6-dione
Synonyms:
6466-37-1;NSC95900;8-(cyclohexylsulfanyl)-1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione;DTXSID80294344;NSC-95900;ZINC13284951

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8-cyclohexylsulfanyl-1,3-dimethyl-7H-purine-2,6-dione Basic Attributes

Molecular Weight：

294.38 g/mol

Exact Mass：

294.11504700 g/mol

NSC Number：

95900

DSSTox ID：

DTXSID80294344

Characteristics

PSA：

94.6 Å²

Computed Properties

Molecular Weight:294.38
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:294.11504700
Monoisotopic Mass:294.11504700
Topological Polar Surface Area:94.6
Heavy Atom Count:20
Complexity:413
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 8-cyclohexylsulfanyl-1,3-dimethyl-7H-purine-2,6-dione

Basic Attributes
Characteristics
Computed Properties

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