ChemSpider 2D Image | 3-Cyclopropyl-6-(2-furyl)-1-(4-methoxyphenyl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine | C21H16F3N3O2

3-Cyclopropyl-6-(2-furyl)-1-(4-methoxyphenyl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine

  • Molecular FormulaC21H16F3N3O2
  • Average mass399.366 Da
  • Monoisotopic mass399.119446 Da
  • ChemSpider ID21760547

More details:

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

1H-Pyrazolo[3,4-b]pyridine, 3-cyclopropyl-6-(2-furanyl)-1-(4-methoxyphenyl)-4-(trifluoromethyl)- [ACD/Index Name]
3-Cyclopropyl-6-(2-furyl)-1-(4-methoxyphenyl)-4-(trifluormethyl)-1H-pyrazolo[3,4-b]pyridin [German] [ACD/IUPAC Name]
3-Cyclopropyl-6-(2-furyl)-1-(4-methoxyphenyl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine [ACD/IUPAC Name]
3-Cyclopropyl-6-(2-furyl)-1-(4-méthoxyphényl)-4-(trifluorométhyl)-1H-pyrazolo[3,4-b]pyridine [French] [ACD/IUPAC Name]
1-[3-cyclopropyl-6-(2-furyl)-4-(trifluoromethyl)pyrazolo[5,4-b]pyridinyl]-4-methoxybenzene
3-cyclopropyl-6-(furan-2-yl)-1-(4-methoxyphenyl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine
3-Cyclopropyl-6-furan-2-yl-1-(4-methoxy-phenyl)-4-trifluoromethyl-1H-pyrazolo[3,4-b]pyridine

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

Density: 1.5±0.1 g/cm3
Boiling Point: 480.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.5±3.0 kJ/mol
Flash Point: 244.3±28.7 °C
Index of Refraction: 1.645
Molar Refractivity: 99.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.58
ACD/LogD (pH 5.5): 4.92
ACD/BCF (pH 5.5): 3232.10
ACD/KOC (pH 5.5): 11315.75
ACD/LogD (pH 7.4): 4.92
ACD/BCF (pH 7.4): 3232.12
ACD/KOC (pH 7.4): 11315.82
Polar Surface Area: 53 Å2
Polarizability: 39.4±0.5 10-24cm3
Surface Tension: 45.2±7.0 dyne/cm
Molar Volume: 274.3±7.0 cm3

Click to predict properties on the Chemicalize site


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