ChemSpider 2D Image | 4-Hydroxy-N-[3-(1-methyl-1H-benzimidazol-2-yl)propyl]-6-(trifluoromethoxy)-3-quinolinecarboxamide | C22H19F3N4O3

4-Hydroxy-N-[3-(1-methyl-1H-benzimidazol-2-yl)propyl]-6-(trifluoromethoxy)-3-quinolinecarboxamide

  • Molecular FormulaC22H19F3N4O3
  • Average mass444.406 Da
  • Monoisotopic mass444.140930 Da
  • ChemSpider ID34498657

More details:

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

3-Quinolinecarboxamide, 4-hydroxy-N-[3-(1-methyl-1H-benzimidazol-2-yl)propyl]-6-(trifluoromethoxy)- [ACD/Index Name]
4-Hydroxy-N-[3-(1-methyl-1H-benzimidazol-2-yl)propyl]-6-(trifluormethoxy)-3-chinolincarboxamid [German] [ACD/IUPAC Name]
4-Hydroxy-N-[3-(1-méthyl-1H-benzimidazol-2-yl)propyl]-6-(trifluorométhoxy)-3-quinoléinecarboxamide [French] [ACD/IUPAC Name]
4-Hydroxy-N-[3-(1-methyl-1H-benzimidazol-2-yl)propyl]-6-(trifluoromethoxy)-3-quinolinecarboxamide [ACD/IUPAC Name]
1676101-81-7 [RN]
4-hydroxy-N-(3-(1-methyl-1H-benzo[d]imidazol-2-yl)propyl)-6-(trifluoromethoxy)quinoline-3-carboxamide
4-hydroxy-N-[3-(1-methyl-1H-benzimidazol-2-yl)propyl]-6-(trifluoromethoxy)quinoline-3-carboxamide
N-[3-(1-methyl-1H-benzimidazol-2-yl)propyl]-4-oxo-6-(trifluoromethoxy)-1,4-dihydroquinoline-3-carboxamide
N-[3-(1-methylbenzimidazol-2-yl)propyl]-4-oxo-6-(trifluoromethoxy)-1H-quinoline-3-carboxamide

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 660.2±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 100.7±3.0 kJ/mol
    Flash Point: 353.1±31.5 °C
    Index of Refraction: 1.623
    Molar Refractivity: 109.9±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 1
    ACD/LogP: 5.71
    ACD/LogD (pH 5.5): 1.68
    ACD/BCF (pH 5.5): 2.65
    ACD/KOC (pH 5.5): 12.79
    ACD/LogD (pH 7.4): 1.99
    ACD/BCF (pH 7.4): 5.38
    ACD/KOC (pH 7.4): 25.97
    Polar Surface Area: 89 Å2
    Polarizability: 43.6±0.5 10-24cm3
    Surface Tension: 47.1±7.0 dyne/cm
    Molar Volume: 311.6±7.0 cm3

    Click to predict properties on the Chemicalize site


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