ChemSpider 2D Image | 1-(1,1-Dioxidotetrahydro-3-thiophenyl)-N-(3-fluorophenyl)-6-(2-furyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide | C22H19FN4O4S

1-(1,1-Dioxidotetrahydro-3-thiophenyl)-N-(3-fluorophenyl)-6-(2-furyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide

  • Molecular FormulaC22H19FN4O4S
  • Average mass454.474 Da
  • Monoisotopic mass454.111115 Da
  • ChemSpider ID22341139

More details:

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

1-(1,1-Dioxidotetrahydro-3-thiophenyl)-N-(3-fluorophenyl)-6-(2-furyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide [ACD/IUPAC Name]
1-(1,1-Dioxidotetrahydro-3-thiophenyl)-N-(3-fluorphenyl)-6-(2-furyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-4-carboxamid [German] [ACD/IUPAC Name]
1-(1,1-Dioxydotétrahydro-3-thiophényl)-N-(3-fluorophényl)-6-(2-furyl)-3-méthyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide [French] [ACD/IUPAC Name]
1H-Pyrazolo[3,4-b]pyridine-4-carboxamide, N-(3-fluorophenyl)-6-(2-furanyl)-3-methyl-1-(tetrahydro-1,1-dioxido-3-thienyl)- [ACD/Index Name]
1-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(3-fluorophenyl)-6-(furan-2-yl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
1-(1,1-dioxo-1λ6-thiolan-3-yl)-N-(3-fluorophenyl)-6-(furan-2-yl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
1021216-01-2 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 657.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.8±3.0 kJ/mol
Flash Point: 351.3±31.5 °C
Index of Refraction: 1.716
Molar Refractivity: 116.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.86
ACD/LogD (pH 5.5): 1.76
ACD/BCF (pH 5.5): 12.91
ACD/KOC (pH 5.5): 217.21
ACD/LogD (pH 7.4): 1.76
ACD/BCF (pH 7.4): 12.90
ACD/KOC (pH 7.4): 217.08
Polar Surface Area: 115 Å2
Polarizability: 46.0±0.5 10-24cm3
Surface Tension: 60.3±7.0 dyne/cm
Molar Volume: 294.9±7.0 cm3

Click to predict properties on the Chemicalize site


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