ChemSpider 2D Image | N-(4-Isopropylphenyl)-1-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidinecarboxamide | C21H23F3N6O

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

  • Molecular FormulaC21H23F3N6O
  • Average mass432.442 Da
  • Monoisotopic mass432.188538 Da
  • ChemSpider ID22488327

More details:

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

4-Piperidinecarboxamide, N-[4-(1-methylethyl)phenyl]-1-[3-(trifluoromethyl)-1,2,4-triazolo[4,3-b]pyridazin-6-yl]- [ACD/Index Name]
N-(4-Isopropylphenyl)-1-[3-(trifluormethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidincarboxamid [German] [ACD/IUPAC Name]
N-(4-Isopropylphenyl)-1-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidinecarboxamide [ACD/IUPAC Name]
N-(4-Isopropylphényl)-1-[3-(trifluorométhyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
1081141-13-0 [RN]
AGN-PC-062EKG
AKOS016376301
MCULE-3085839900
MolPort-007-155-754
N-(4-isopropylphenyl)-1-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide
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    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: 1.636
    Molar Refractivity: 109.9±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.43
    ACD/LogD (pH 5.5): 2.75
    ACD/BCF (pH 5.5): 72.85
    ACD/KOC (pH 5.5): 749.42
    ACD/LogD (pH 7.4): 2.75
    ACD/BCF (pH 7.4): 72.87
    ACD/KOC (pH 7.4): 749.60
    Polar Surface Area: 75 Å2
    Polarizability: 43.6±0.5 10-24cm3
    Surface Tension: 46.3±7.0 dyne/cm
    Molar Volume: 306.4±7.0 cm3

    Click to predict properties on the Chemicalize site


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