ChemSpider 2D Image | N-{4-[(6,7-Dimethoxy-4-quinolinyl)oxy]-3-fluorophenyl}-N,1,5-trimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxamide | C30H27FN4O5

N-{4-[(6,7-Dimethoxy-4-quinolinyl)oxy]-3-fluorophenyl}-N,1,5-trimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxamide

  • Molecular FormulaC30H27FN4O5
  • Average mass542.558 Da
  • Monoisotopic mass542.196533 Da
  • ChemSpider ID10137642

More details:

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

1H-Pyrazole-4-carboxamide, N-[4-[(6,7-dimethoxy-4-quinolinyl)oxy]-3-fluorophenyl]-2,3-dihydro-N,1,5-trimethyl-3-oxo-2-phenyl- [ACD/Index Name]
N-{4-[(6,7-Dimethoxy-4-chinolinyl)oxy]-3-fluorphenyl}-N,1,5-trimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-carboxamid [German] [ACD/IUPAC Name]
N-{4-[(6,7-Diméthoxy-4-quinoléinyl)oxy]-3-fluorophényl}-N,1,5-triméthyl-3-oxo-2-phényl-2,3-dihydro-1H-pyrazole-4-carboxamide [French] [ACD/IUPAC Name]
N-{4-[(6,7-Dimethoxy-4-quinolinyl)oxy]-3-fluorophenyl}-N,1,5-trimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxamide [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 646.1±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: 344.6±34.3 °C
Index of Refraction: 1.649
Molar Refractivity: 148.7±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.14
ACD/LogD (pH 5.5): 2.74
ACD/BCF (pH 5.5): 64.68
ACD/KOC (pH 5.5): 613.36
ACD/LogD (pH 7.4): 2.91
ACD/BCF (pH 7.4): 96.39
ACD/KOC (pH 7.4): 914.11
Polar Surface Area: 84 Å2
Polarizability: 59.0±0.5 10-24cm3
Surface Tension: 55.8±3.0 dyne/cm
Molar Volume: 408.1±3.0 cm3

Click to predict properties on the Chemicalize site


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