ChemSpider 2D Image | TCMDC-135294 | C12H10N4O2S2

TCMDC-135294

  • Molecular FormulaC12H10N4O2S2
  • Average mass306.363 Da
  • Monoisotopic mass306.024506 Da
  • ChemSpider ID24575349

More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

3-(4-Aminothieno[3,2-d]pyrimidin-6-yl)benzenesulfonamide [ACD/IUPAC Name]
3-(4-Aminothiéno[3,2-d]pyrimidin-6-yl)benzènesulfonamide [French] [ACD/IUPAC Name]
3-(4-Aminothieno[3,2-d]pyrimidin-6-yl)benzolsulfonamid [German] [ACD/IUPAC Name]
benzenesulfonamide, 3-(4-aminothieno[3,2-d]pyrimidin-6-yl)- [ACD/Index Name]
TCMDC-135294
  • Miscellaneous
    • Bio Activity:

      XC50_3D7 (uM) (Plasmodium Falciparum, Malaria): 0.150637379 GlaxoSmithKline Malaria Set

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 646.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.3±3.0 kJ/mol
Flash Point: 344.5±34.3 °C
Index of Refraction: 1.737
Molar Refractivity: 78.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.87
ACD/LogD (pH 5.5): 1.12
ACD/BCF (pH 5.5): 3.90
ACD/KOC (pH 5.5): 85.06
ACD/LogD (pH 7.4): 1.24
ACD/BCF (pH 7.4): 5.16
ACD/KOC (pH 7.4): 112.45
Polar Surface Area: 149 Å2
Polarizability: 31.2±0.5 10-24cm3
Surface Tension: 84.3±3.0 dyne/cm
Molar Volume: 196.0±3.0 cm3

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