ChemSpider 2D Image | N-[3-(2-Thienyl)-1H-pyrazol-5-yl]-1-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidinecarboxamide | C19H17F3N8OS

N-[3-(2-Thienyl)-1H-pyrazol-5-yl]-1-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidinecarboxamide

  • Molecular FormulaC19H17F3N8OS
  • Average mass462.452 Da
  • Monoisotopic mass462.119812 Da
  • ChemSpider ID70802876

More details:

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

4-Piperidinecarboxamide, N-[3-(2-thienyl)-1H-pyrazol-5-yl]-1-[3-(trifluoromethyl)-1,2,4-triazolo[4,3-b]pyridazin-6-yl]- [ACD/Index Name]
N-[3-(2-Thienyl)-1H-pyrazol-5-yl]-1-[3-(trifluormethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidincarboxamid [German] [ACD/IUPAC Name]
N-[3-(2-Thienyl)-1H-pyrazol-5-yl]-1-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidinecarboxamide [ACD/IUPAC Name]
N-[3-(2-Thiényl)-1H-pyrazol-5-yl]-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: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.767
Molar Refractivity: 112.4±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.58
ACD/LogD (pH 5.5): 2.03
ACD/BCF (pH 5.5): 20.40
ACD/KOC (pH 5.5): 301.12
ACD/LogD (pH 7.4): 2.03
ACD/BCF (pH 7.4): 20.41
ACD/KOC (pH 7.4): 301.23
Polar Surface Area: 132 Å2
Polarizability: 44.6±0.5 10-24cm3
Surface Tension: 65.3±7.0 dyne/cm
Molar Volume: 271.3±7.0 cm3

Click to predict properties on the Chemicalize site


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