ChemSpider 2D Image | 1-[4-([1,2,4]Triazolo[4,3-a]pyridin-3-yl)-1-piperidinyl]-2-{[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}ethanone | C19H17F3N8OS

1-[4-([1,2,4]Triazolo[4,3-a]pyridin-3-yl)-1-piperidinyl]-2-{[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}ethanone

  • Molecular FormulaC19H17F3N8OS
  • Average mass462.452 Da
  • Monoisotopic mass462.119812 Da
  • ChemSpider ID112255286

More details:

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

1-[4-([1,2,4]Triazolo[4,3-a]pyridin-3-yl)-1-piperidinyl]-2-{[3-(trifluormethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}ethanon [German] [ACD/IUPAC Name]
1-[4-([1,2,4]Triazolo[4,3-a]pyridin-3-yl)-1-piperidinyl]-2-{[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}ethanone [ACD/IUPAC Name]
1-[4-([1,2,4]Triazolo[4,3-a]pyridin-3-yl)-1-pipéridinyl]-2-{[3-(trifluorométhyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[4-(1,2,4-triazolo[4,3-a]pyridin-3-yl)-1-piperidinyl]-2-[[3-(trifluoromethyl)-1,2,4-triazolo[4,3-b]pyridazin-6-yl]thio]- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.753
Molar Refractivity: 113.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.10
ACD/LogD (pH 5.5): 1.71
ACD/BCF (pH 5.5): 11.64
ACD/KOC (pH 5.5): 200.94
ACD/LogD (pH 7.4): 1.71
ACD/BCF (pH 7.4): 11.79
ACD/KOC (pH 7.4): 203.54
Polar Surface Area: 119 Å2
Polarizability: 44.9±0.5 10-24cm3
Surface Tension: 64.4±7.0 dyne/cm
Molar Volume: 277.4±7.0 cm3

Click to predict properties on the Chemicalize site


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