ChemSpider 2D Image | 1-(4-Fluorophenyl)-N-methyl-3-(4-methylphenyl)-N-(2-{[4-(4-morpholinyl)phenyl]amino}-2-oxoethyl)-1H-pyrazole-4-carboxamide | C30H30FN5O3

1-(4-Fluorophenyl)-N-methyl-3-(4-methylphenyl)-N-(2-{[4-(4-morpholinyl)phenyl]amino}-2-oxoethyl)-1H-pyrazole-4-carboxamide

  • Molecular FormulaC30H30FN5O3
  • Average mass527.589 Da
  • Monoisotopic mass527.233276 Da
  • ChemSpider ID21972955

More details:

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

1-(4-Fluorophenyl)-N-methyl-3-(4-methylphenyl)-N-(2-{[4-(4-morpholinyl)phenyl]amino}-2-oxoethyl)-1H-pyrazole-4-carboxamide [ACD/IUPAC Name]
1-(4-Fluorophényl)-N-méthyl-3-(4-méthylphényl)-N-(2-{[4-(4-morpholinyl)phényl]amino}-2-oxoéthyl)-1H-pyrazole-4-carboxamide [French] [ACD/IUPAC Name]
1-(4-Fluorphenyl)-N-methyl-3-(4-methylphenyl)-N-(2-{[4-(4-morpholinyl)phenyl]amino}-2-oxoethyl)-1H-pyrazol-4-carboxamid [German] [ACD/IUPAC Name]
1H-Pyrazole-4-carboxamide, 1-(4-fluorophenyl)-N-methyl-3-(4-methylphenyl)-N-[2-[[4-(4-morpholinyl)phenyl]amino]-2-oxoethyl]- [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: 789.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 114.8±3.0 kJ/mol
Flash Point: 431.1±32.9 °C
Index of Refraction: 1.633
Molar Refractivity: 148.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.22
ACD/LogD (pH 5.5): 3.09
ACD/BCF (pH 5.5): 101.48
ACD/KOC (pH 5.5): 695.60
ACD/LogD (pH 7.4): 3.56
ACD/BCF (pH 7.4): 296.51
ACD/KOC (pH 7.4): 2032.42
Polar Surface Area: 80 Å2
Polarizability: 58.9±0.5 10-24cm3
Surface Tension: 48.1±7.0 dyne/cm
Molar Volume: 416.2±7.0 cm3

Click to predict properties on the Chemicalize site


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