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Chemical Properties of .alpha.-[PURINE-6-YLAMINO]-p-TOLUENESULFONAMIDE

.alpha.-[PURINE-6-YLAMINO]-p-TOLUENESULFONAMIDE

InChI
InChI=1S/C12H12N6O2S/c13-21(19,20)9-3-1-8(2-4-9)5-14-11-10-12(16-6-15-10)18-7-17-11/h1-4,6-7H,5H2,(H2,13,19,20)(H2,14,15,16,17,18)
InChI Key
MGZJAXYRCXYPPD-UHFFFAOYSA-N
Formula
C12H12N6O2S
SMILES
NS(=O)(=O)c1ccc(CNc2ncnc3[nH]cnc23)cc1
Molecular Weight1
304.33
Other Names
  • «alpha»-[Purine-6-ylamino]-p-toluenesulfonamide
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Physical Properties

Property Value Unit Source
IE 8.23 eV Relay (1.0) Calculated Property
log10WS -3.81 Relay (1.0) Calculated Property
logPoct/wat 0.130 Crippen Calculated Property
McVol 205.230 ml/mol McGowan Calculated Property
Tfus 568.35 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Benzyladenine. Argentamin. Epibaptifoline. (2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane. Formosanan-16-carboxylic acid, 19-methyl-2-oxo-, methyl ester, (19«alpha»)-. risperidone. (1'S,3R,4a'S,5a'S,10a'S)-Methyl 1'-methyl-2-oxo-1',4a',5',5a',7',8',10',10a'-octahydrospiro[indoline-3,6'-pyrano[3,4-f]indolizine]-4'-carboxylate. 1H-pyrazolo[3,4-d]pyrimidine, 4-(methylthio)-1-beta-d-ribofuranosyl-, 2',3',5'-tribenzoate. Baptifoline. Diacetylmorphine. AJMALINE, M(NOR-), AC. Jaconine. 6-O,N-Diacetylnorcodeine. Norcodeine. Dehydrojaconine.

Find more compounds similar to .alpha.-[PURINE-6-YLAMINO]-p-TOLUENESULFONAMIDE.

Sources

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