ChemSpider 2D Image | 4-(4-{3-[4-Chloro-3-(trifluoromethyl)phenyl]-5-methyl-2-oxo-1,3,5-triazinan-1-yl}phenoxy)-N-methyl-2-pyridinecarboxamide | C24H21ClF3N5O3

4-(4-{3-[4-Chloro-3-(trifluoromethyl)phenyl]-5-methyl-2-oxo-1,3,5-triazinan-1-yl}phenoxy)-N-methyl-2-pyridinecarboxamide

  • Molecular FormulaC24H21ClF3N5O3
  • Average mass519.903 Da
  • Monoisotopic mass519.128479 Da
  • ChemSpider ID8025246

More details:

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

2-Pyridinecarboxamide, 4-[4-[3-[4-chloro-3-(trifluoromethyl)phenyl]tetrahydro-5-methyl-2-oxo-1,3,5-triazin-1(2H)-yl]phenoxy]-N-methyl- [ACD/Index Name]
4-(4-{3-[4-Chlor-3-(trifluormethyl)phenyl]-5-methyl-2-oxo-1,3,5-triazinan-1-yl}phenoxy)-N-methyl-2-pyridincarboxamid [German] [ACD/IUPAC Name]
4-(4-{3-[4-Chloro-3-(trifluoromethyl)phenyl]-5-methyl-2-oxo-1,3,5-triazinan-1-yl}phenoxy)-N-methyl-2-pyridinecarboxamide [ACD/IUPAC Name]
4-(4-{3-[4-Chloro-3-(trifluorométhyl)phényl]-5-méthyl-2-oxo-1,3,5-triazinan-1-yl}phénoxy)-N-méthyl-2-pyridinecarboxamide [French] [ACD/IUPAC 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: 659.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.1±3.0 kJ/mol
Flash Point: 352.9±31.5 °C
Index of Refraction: 1.590
Molar Refractivity: 126.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 2.47
ACD/LogD (pH 5.5): 2.92
ACD/BCF (pH 5.5): 96.63
ACD/KOC (pH 5.5): 910.79
ACD/LogD (pH 7.4): 2.93
ACD/BCF (pH 7.4): 99.08
ACD/KOC (pH 7.4): 933.92
Polar Surface Area: 78 Å2
Polarizability: 50.1±0.5 10-24cm3
Surface Tension: 49.3±3.0 dyne/cm
Molar Volume: 374.1±3.0 cm3

Click to predict properties on the Chemicalize site


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