ChemSpider 2D Image | 5-(3,4-Dimethoxyphenyl)-N-(1,1-dioxidotetrahydro-3-thiophenyl)-1H-pyrazole-3-carboxamide | C16H19N3O5S

5-(3,4-Dimethoxyphenyl)-N-(1,1-dioxidotetrahydro-3-thiophenyl)-1H-pyrazole-3-carboxamide

  • Molecular FormulaC16H19N3O5S
  • Average mass365.404 Da
  • Monoisotopic mass365.104553 Da
  • ChemSpider ID29345783

More details:

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

1H-Pyrazole-3-carboxamide, 5-(3,4-dimethoxyphenyl)-N-(tetrahydro-1,1-dioxido-3-thienyl)- [ACD/Index Name]
5-(3,4-Dimethoxyphenyl)-N-(1,1-dioxidotetrahydro-3-thiophenyl)-1H-pyrazol-3-carboxamid [German] [ACD/IUPAC Name]
5-(3,4-Dimethoxyphenyl)-N-(1,1-dioxidotetrahydro-3-thiophenyl)-1H-pyrazole-3-carboxamide [ACD/IUPAC Name]
5-(3,4-Diméthoxyphényl)-N-(1,1-dioxydotétrahydro-3-thiophényl)-1H-pyrazole-3-carboxamide [French] [ACD/IUPAC Name]
3-(3,4-dimethoxyphenyl)-N-(1,1-dioxothiolan-3-yl)-1H-pyrazole-5-carboxamide
5-(3,4-Dimethoxy-phenyl)-1H-pyrazole-3-carboxylic acid (1,1-dioxo-tetrahydro-1λ*6*-thiophen-3-yl)-amide
5-(3,4-dimethoxyphenyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-1H-pyrazole-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: 703.1±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 102.9±3.0 kJ/mol
    Flash Point: 379.0±32.9 °C
    Index of Refraction: 1.623
    Molar Refractivity: 89.6±0.4 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: -1.29
    ACD/LogD (pH 5.5): -0.29
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 16.62
    ACD/LogD (pH 7.4): -0.29
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 16.35
    Polar Surface Area: 119 Å2
    Polarizability: 35.5±0.5 10-24cm3
    Surface Tension: 68.8±5.0 dyne/cm
    Molar Volume: 254.1±5.0 cm3

    Click to predict properties on the Chemicalize site


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