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Search term: MF = 'C_{16}H_{16}F_{3}N_{5}O_{2}'

ChemSpider 2D Image | 3-Methyl-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-N-[3-(trifluoromethyl)-1H-1,2,4-triazol-5-yl]butanamide | C16H16F3N5O2

3-Methyl-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-N-[3-(trifluoromethyl)-1H-1,2,4-triazol-5-yl]butanamide

  • Molecular FormulaC16H16F3N5O2
  • Average mass367.326 Da
  • Monoisotopic mass367.125610 Da
  • ChemSpider ID29347739

More details:






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

2H-Isoindole-2-acetamide, 1,3-dihydro-α-(1-methylethyl)-1-oxo-N-[3-(trifluoromethyl)-1H-1,2,4-triazol-5-yl]- [ACD/Index Name]
3-Methyl-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-N-[3-(trifluormethyl)-1H-1,2,4-triazol-5-yl]butanamid [German] [ACD/IUPAC Name]
3-Methyl-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-N-[3-(trifluoromethyl)-1H-1,2,4-triazol-5-yl]butanamide [ACD/IUPAC Name]
3-Méthyl-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-N-[3-(trifluorométhyl)-1H-1,2,4-triazol-5-yl]butanamide [French] [ACD/IUPAC Name]
3-methyl-2-(3-oxo-1H-isoindol-2-yl)-N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]butanamide

    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: 1.597
    Molar Refractivity: 85.4±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.40
    ACD/LogD (pH 5.5): 1.73
    ACD/BCF (pH 5.5): 11.92
    ACD/KOC (pH 5.5): 202.40
    ACD/LogD (pH 7.4): 1.08
    ACD/BCF (pH 7.4): 2.69
    ACD/KOC (pH 7.4): 45.69
    Polar Surface Area: 91 Å2
    Polarizability: 33.9±0.5 10-24cm3
    Surface Tension: 61.3±3.0 dyne/cm
    Molar Volume: 250.8±3.0 cm3

    Click to predict properties on the Chemicalize site






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