ChemSpider 2D Image | N-{4-[(1-Methyl-1H-imidazol-2-yl)carbonyl]phenyl}-1-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidinecarboxamide | C23H21F3N8O2

N-{4-[(1-Methyl-1H-imidazol-2-yl)carbonyl]phenyl}-1-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidinecarboxamide

  • Molecular FormulaC23H21F3N8O2
  • Average mass498.460 Da
  • Monoisotopic mass498.173950 Da
  • ChemSpider ID70760231

More details:

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

4-Piperidinecarboxamide, N-[4-[(1-methyl-1H-imidazol-2-yl)carbonyl]phenyl]-1-[3-(trifluoromethyl)-1,2,4-triazolo[4,3-b]pyridazin-6-yl]- [ACD/Index Name]
N-{4-[(1-Methyl-1H-imidazol-2-yl)carbonyl]phenyl}-1-[3-(trifluormethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidincarboxamid [German] [ACD/IUPAC Name]
N-{4-[(1-Methyl-1H-imidazol-2-yl)carbonyl]phenyl}-1-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidinecarboxamide [ACD/IUPAC Name]
N-{4-[(1-Méthyl-1H-imidazol-2-yl)carbonyl]phényl}-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: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.697
Molar Refractivity: 124.6±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 1.72
ACD/LogD (pH 5.5): 1.40
ACD/BCF (pH 5.5): 6.80
ACD/KOC (pH 5.5): 136.57
ACD/LogD (pH 7.4): 1.41
ACD/BCF (pH 7.4): 6.91
ACD/KOC (pH 7.4): 138.81
Polar Surface Area: 110 Å2
Polarizability: 49.4±0.5 10-24cm3
Surface Tension: 57.0±7.0 dyne/cm
Molar Volume: 323.4±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement