ChemSpider 2D Image | 1-Benzyl-N-cyclopropyl-N'-[2-fluoro-4-(trifluoromethyl)benzyl]-4-oxo-1,4-dihydro-3,5-pyridinedicarboxamide | C25H21F4N3O3

1-Benzyl-N-cyclopropyl-N'-[2-fluoro-4-(trifluoromethyl)benzyl]-4-oxo-1,4-dihydro-3,5-pyridinedicarboxamide

  • Molecular FormulaC25H21F4N3O3
  • Average mass487.446 Da
  • Monoisotopic mass487.151917 Da
  • ChemSpider ID22136418

More details:

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

1-Benzyl-N-cyclopropyl-N'-[2-fluor-4-(trifluormethyl)benzyl]-4-oxo-1,4-dihydro-3,5-pyridindicarboxamid [German] [ACD/IUPAC Name]
1-Benzyl-N-cyclopropyl-N'-[2-fluoro-4-(trifluoromethyl)benzyl]-4-oxo-1,4-dihydro-3,5-pyridinedicarboxamide [ACD/IUPAC Name]
1-Benzyl-N-cyclopropyl-N'-[2-fluoro-4-(trifluorométhyl)benzyl]-4-oxo-1,4-dihydro-3,5-pyridinedicarboxamide [French] [ACD/IUPAC Name]
3,5-Pyridinedicarboxamide, N3-cyclopropyl-N5-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]-1,4-dihydro-4-oxo-1-(phenylmethyl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 690.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.2±3.0 kJ/mol
Flash Point: 371.4±31.5 °C
Index of Refraction: 1.611
Molar Refractivity: 118.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.84
ACD/LogD (pH 5.5): 2.01
ACD/BCF (pH 5.5): 19.69
ACD/KOC (pH 5.5): 293.84
ACD/LogD (pH 7.4): 2.01
ACD/BCF (pH 7.4): 19.67
ACD/KOC (pH 7.4): 293.43
Polar Surface Area: 79 Å2
Polarizability: 47.1±0.5 10-24cm3
Surface Tension: 54.9±5.0 dyne/cm
Molar Volume: 342.6±5.0 cm3

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