Chemical Properties of Purine, 6-benzylthio- (CAS 724-34-5)

Purine, 6-benzylthio-

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InChI
InChI=1S/C12H10N4S/c1-2-4-9(5-3-1)6-17-12-10-11(14-7-13-10)15-8-16-12/h1-5,7-8H,6H2,(H,13,14,15,16)
InChI Key
ULIQGBPQLPCTAJ-UHFFFAOYSA-N
Formula
C12H10N4S
SMILES
c1ccc(CSc2ncnc3[nH]cnc23)cc1
Molecular Weight1
242.30
CAS
724-34-5
Other Names
  • 6-[(phenylmethyl)thio]-1H-purine
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Physical Properties

Property Value Unit Source
log10WS -4.65 Crippen Calculated Property
logPoct/wat 2.163 Crippen Calculated Property
McVol 173.530 ml/mol McGowan Calculated Property

Similar Compounds

Purine, 2,6-bis(benzylthio)-. Purine, 6-(o-chlorobenzyl thio)-. Purine, 6-(m-fluorobenzylthio)-. Purine, 2-amino-6-benzylthio-. Purine, 6-(o-fluorobenzylthio)-. p-Toluenesulfonamide, alpha-[6-(methylthio)-9H-purin-9-yl]-. Levophacetoperane. 11-Allylcytisine. 5'-S-Methyl-5'-thioadenosine, bis(trimethylsilyl) deriv.. Methyl-12-cytisine acetate. 5-Hydroxytryptophan, methyl, 3-PFP. Morazone. Cytisine, N-formyl-. Anagyrine. Cytisine.

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Sources

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