ChemSpider 2D Image | N-{3-[5-Amino-4-cyano-1-(4-fluorophenyl)-1H-pyrazol-3-yl]propyl}-2-quinoxalinecarboxamide | C22H18FN7O

N-{3-[5-Amino-4-cyano-1-(4-fluorophenyl)-1H-pyrazol-3-yl]propyl}-2-quinoxalinecarboxamide

  • Molecular FormulaC22H18FN7O
  • Average mass415.423 Da
  • Monoisotopic mass415.155701 Da
  • ChemSpider ID29999034

More details:






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

2-Quinoxalinecarboxamide, N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)-1H-pyrazol-3-yl]propyl]- [ACD/Index Name]
N-{3-[5-Amino-4-cyan-1-(4-fluorphenyl)-1H-pyrazol-3-yl]propyl}-2-chinoxalincarboxamid [German] [ACD/IUPAC Name]
N-{3-[5-Amino-4-cyano-1-(4-fluorophenyl)-1H-pyrazol-3-yl]propyl}-2-quinoxalinecarboxamide [ACD/IUPAC Name]
N-{3-[5-Amino-4-cyano-1-(4-fluorophényl)-1H-pyrazol-3-yl]propyl}-2-quinoxalinecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 730.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.6±3.0 kJ/mol
Flash Point: 395.4±32.9 °C
Index of Refraction: 1.701
Molar Refractivity: 114.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.68
ACD/LogD (pH 5.5): 2.38
ACD/BCF (pH 5.5): 37.62
ACD/KOC (pH 5.5): 466.97
ACD/LogD (pH 7.4): 2.38
ACD/BCF (pH 7.4): 37.62
ACD/KOC (pH 7.4): 466.94
Polar Surface Area: 123 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 58.5±7.0 dyne/cm
Molar Volume: 295.8±7.0 cm3

Click to predict properties on the Chemicalize site






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