ChemSpider 2D Image | N-[1-(4-Fluorophenyl)ethyl]-N-methyl-1-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidinecarboxamide | C21H22F4N6O

N-[1-(4-Fluorophenyl)ethyl]-N-methyl-1-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidinecarboxamide

  • Molecular FormulaC21H22F4N6O
  • Average mass450.433 Da
  • Monoisotopic mass450.179108 Da
  • ChemSpider ID33069744

More details:

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

4-Piperidinecarboxamide, N-[1-(4-fluorophenyl)ethyl]-N-methyl-1-[3-(trifluoromethyl)-1,2,4-triazolo[4,3-b]pyridazin-6-yl]- [ACD/Index Name]
N-[1-(4-Fluorophenyl)ethyl]-N-methyl-1-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidinecarboxamide [ACD/IUPAC Name]
N-[1-(4-Fluorophényl)éthyl]-N-méthyl-1-[3-(trifluorométhyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
N-[1-(4-Fluorphenyl)ethyl]-N-methyl-1-[3-(trifluormethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidincarboxamid [German] [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.619
Molar Refractivity: 110.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.44
ACD/LogD (pH 5.5): 2.13
ACD/BCF (pH 5.5): 24.33
ACD/KOC (pH 5.5): 341.79
ACD/LogD (pH 7.4): 2.13
ACD/BCF (pH 7.4): 24.33
ACD/KOC (pH 7.4): 341.86
Polar Surface Area: 67 Å2
Polarizability: 43.9±0.5 10-24cm3
Surface Tension: 44.4±7.0 dyne/cm
Molar Volume: 315.3±7.0 cm3

Click to predict properties on the Chemicalize site


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