ChemSpider 2D Image | 1-(3,5-Difluorophenyl)-N-(3-methoxypropyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide | C18H18F2N4O2

1-(3,5-Difluorophenyl)-N-(3-methoxypropyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide

  • Molecular FormulaC18H18F2N4O2
  • Average mass360.358 Da
  • Monoisotopic mass360.139771 Da
  • ChemSpider ID27321029

More details:

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

1-(3,5-Difluorophenyl)-N-(3-methoxypropyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide [ACD/IUPAC Name]
1-(3,5-Difluorophényl)-N-(3-méthoxypropyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide [French] [ACD/IUPAC Name]
1-(3,5-Difluorphenyl)-N-(3-methoxypropyl)-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-carboxamid [German] [ACD/IUPAC Name]
1H-Pyrazole-4-carboxamide, 1-(3,5-difluorophenyl)-N-(3-methoxypropyl)-5-(1H-pyrrol-1-yl)- [ACD/Index Name]
1-(3,5-Difluoro-phenyl)-5-pyrrol-1-yl-1H-pyrazole-4-carboxylic acid (3-methoxy-propyl)-amide
1-(3,5-difluorophenyl)-N-(3-methoxypropyl)-5-pyrrol-1-ylpyrazole-4-carboxamide
1246059-97-1 [RN]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 533.4±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 80.9±3.0 kJ/mol
    Flash Point: 276.4±30.1 °C
    Index of Refraction: 1.593
    Molar Refractivity: 93.7±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 2.41
    ACD/LogD (pH 5.5): 2.09
    ACD/BCF (pH 5.5): 20.76
    ACD/KOC (pH 5.5): 272.45
    ACD/LogD (pH 7.4): 0.80
    ACD/BCF (pH 7.4): 1.07
    ACD/KOC (pH 7.4): 13.98
    Polar Surface Area: 61 Å2
    Polarizability: 37.1±0.5 10-24cm3
    Surface Tension: 43.6±7.0 dyne/cm
    Molar Volume: 276.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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