ChemSpider 2D Image | 4-[3-(4-Fluorophenyl)-6,7-dihydro[1,2]oxazolo[4,3-c]pyridin-5(4H)-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine | C23H17FN6O

4-[3-(4-Fluorophenyl)-6,7-dihydro[1,2]oxazolo[4,3-c]pyridin-5(4H)-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine

  • Molecular FormulaC23H17FN6O
  • Average mass412.419 Da
  • Monoisotopic mass412.144775 Da
  • ChemSpider ID34728730

More details:

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

4-[3-(4-Fluorophenyl)-6,7-dihydro[1,2]oxazolo[4,3-c]pyridin-5(4H)-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine [ACD/IUPAC Name]
4-[3-(4-Fluorophényl)-6,7-dihydro[1,2]oxazolo[4,3-c]pyridin-5(4H)-yl]-1-phényl-1H-pyrazolo[3,4-d]pyrimidine [French] [ACD/IUPAC Name]
4-[3-(4-Fluorphenyl)-6,7-dihydro[1,2]oxazolo[4,3-c]pyridin-5(4H)-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin [German] [ACD/IUPAC Name]
Isoxazolo[4,3-c]pyridine, 3-(4-fluorophenyl)-4,5,6,7-tetrahydro-5-(1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 614.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.1±3.0 kJ/mol
Flash Point: 325.1±31.5 °C
Index of Refraction: 1.750
Molar Refractivity: 114.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.90
ACD/LogD (pH 5.5): 3.56
ACD/BCF (pH 5.5): 298.85
ACD/KOC (pH 5.5): 2046.60
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 304.88
ACD/KOC (pH 7.4): 2087.92
Polar Surface Area: 73 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 59.2±7.0 dyne/cm
Molar Volume: 281.3±7.0 cm3

Click to predict properties on the Chemicalize site


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