ChemSpider 2D Image | (4E)-5-Methyl-2-phenyl-4-[phenyl(8-quinolinylamino)methylene]-2,4-dihydro-3H-pyrazol-3-one | C26H20N4O

(4E)-5-Methyl-2-phenyl-4-[phenyl(8-quinolinylamino)methylene]-2,4-dihydro-3H-pyrazol-3-one

  • Molecular FormulaC26H20N4O
  • Average mass404.463 Da
  • Monoisotopic mass404.163696 Da
  • ChemSpider ID30655226

  • Double-bond stereo - Double-bond stereo

More details:

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

(4E)-4-[(8-Chinolinylamino)(phenyl)methylen]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-on [German] [ACD/IUPAC Name]
(4E)-5-Méthyl-2-phényl-4-[phényl(8-quinoléinylamino)méthylène]-2,4-dihydro-3H-pyrazol-3-one [French] [ACD/IUPAC Name]
(4E)-5-Methyl-2-phenyl-4-[phenyl(8-quinolinylamino)methylene]-2,4-dihydro-3H-pyrazol-3-one [ACD/IUPAC Name]
3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-2-phenyl-4-[phenyl(8-quinolinylamino)methylene]-, (4E)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 581.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.0±3.0 kJ/mol
Flash Point: 305.6±32.9 °C
Index of Refraction: 1.672
Molar Refractivity: 123.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.63
ACD/LogD (pH 5.5): 2.28
ACD/BCF (pH 5.5): 11.65
ACD/KOC (pH 5.5): 61.62
ACD/LogD (pH 7.4): 3.58
ACD/BCF (pH 7.4): 235.07
ACD/KOC (pH 7.4): 1243.94
Polar Surface Area: 58 Å2
Polarizability: 48.9±0.5 10-24cm3
Surface Tension: 49.9±7.0 dyne/cm
Molar Volume: 329.6±7.0 cm3

Click to predict properties on the Chemicalize site


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