ChemSpider 2D Image | N-(2-Methoxybenzyl)-N-methyl-1-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidinecarboxamide | C21H23F3N6O2

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

  • Molecular FormulaC21H23F3N6O2
  • Average mass448.441 Da
  • Monoisotopic mass448.183472 Da
  • ChemSpider ID21710410

More details:

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

4-Piperidinecarboxamide, N-[(2-methoxyphenyl)methyl]-N-methyl-1-[3-(trifluoromethyl)-1,2,4-triazolo[4,3-b]pyridazin-6-yl]- [ACD/Index Name]
N-(2-Methoxybenzyl)-N-methyl-1-[3-(trifluormethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidincarboxamid [German] [ACD/IUPAC Name]
N-(2-Methoxybenzyl)-N-methyl-1-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidinecarboxamide [ACD/IUPAC Name]
N-(2-Méthoxybenzyl)-N-méthyl-1-[3-(trifluorométhyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-pipéridinecarboxamide [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.621
Molar Refractivity: 112.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.95
ACD/LogD (pH 5.5): 1.81
ACD/BCF (pH 5.5): 14.04
ACD/KOC (pH 5.5): 230.63
ACD/LogD (pH 7.4): 1.81
ACD/BCF (pH 7.4): 14.05
ACD/KOC (pH 7.4): 230.68
Polar Surface Area: 76 Å2
Polarizability: 44.5±0.5 10-24cm3
Surface Tension: 46.5±7.0 dyne/cm
Molar Volume: 318.9±7.0 cm3

Click to predict properties on the Chemicalize site


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