ChemSpider 2D Image | 1-[3-(2-Methyl-4-phenyl-3-quinolinyl)-5-(6-quinoxalinyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone | C29H23N5O

1-[3-(2-Methyl-4-phenyl-3-quinolinyl)-5-(6-quinoxalinyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone

  • Molecular FormulaC29H23N5O
  • Average mass457.526 Da
  • Monoisotopic mass457.190247 Da
  • ChemSpider ID30314753

More details:

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

1-[3-(2-Méthyl-4-phényl-3-quinoléinyl)-5-(6-quinoxalinyl)-4,5-dihydro-1H-pyrazol-1-yl]éthanone [French] [ACD/IUPAC Name]
1-[3-(2-Methyl-4-phenyl-3-quinolinyl)-5-(6-quinoxalinyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone [ACD/IUPAC Name]
1-[5-(6-Chinoxalinyl)-3-(2-methyl-4-phenyl-3-chinolinyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanon [German] [ACD/IUPAC Name]
Ethanone, 1-[4,5-dihydro-3-(2-methyl-4-phenyl-3-quinolinyl)-5-(6-quinoxalinyl)-1H-pyrazol-1-yl]- [ACD/Index 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: 662.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.4±3.0 kJ/mol
Flash Point: 354.4±34.3 °C
Index of Refraction: 1.708
Molar Refractivity: 137.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.93
ACD/LogD (pH 5.5): 3.61
ACD/BCF (pH 5.5): 309.91
ACD/KOC (pH 5.5): 2005.21
ACD/LogD (pH 7.4): 3.68
ACD/BCF (pH 7.4): 371.46
ACD/KOC (pH 7.4): 2403.43
Polar Surface Area: 71 Å2
Polarizability: 54.5±0.5 10-24cm3
Surface Tension: 52.3±7.0 dyne/cm
Molar Volume: 353.0±7.0 cm3

Click to predict properties on the Chemicalize site


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