ChemSpider 2D Image | 2-Amino-N-[2-(3,4-diethoxyphenyl)ethyl]-1-(4-ethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide | C31H33N5O4

2-Amino-N-[2-(3,4-diethoxyphenyl)ethyl]-1-(4-ethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

  • Molecular FormulaC31H33N5O4
  • Average mass539.625 Da
  • Monoisotopic mass539.253235 Da
  • ChemSpider ID1520175

More details:

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

1H-Pyrrolo[2,3-b]quinoxaline-3-carboxamide, 2-amino-N-[2-(3,4-diethoxyphenyl)ethyl]-1-(4-ethoxyphenyl)- [ACD/Index Name]
2-Amino-N-[2-(3,4-diethoxyphenyl)ethyl]-1-(4-ethoxyphenyl)-1H-pyrrolo[2,3-b]chinoxalin-3-carboxamid [German] [ACD/IUPAC Name]
2-Amino-N-[2-(3,4-diethoxyphenyl)ethyl]-1-(4-ethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide [ACD/IUPAC Name]
2-Amino-N-[2-(3,4-diéthoxyphényl)éthyl]-1-(4-éthoxyphényl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide [French] [ACD/IUPAC Name]
[2-amino-1-(4-ethoxyphenyl)pyrrolo[2,3-b]quinoxalin-3-yl]-N-[2-(3,4-diethoxyphenyl)ethyl]carboxamide
2-amino-N-[2-(3,4-diethoxyphenyl)ethyl]-1-(4-ethoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide
845899-87-8 [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: 712.5±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.3 mmHg at 25°C
    Enthalpy of Vaporization: 104.2±3.0 kJ/mol
    Flash Point: 384.7±32.9 °C
    Index of Refraction: 1.637
    Molar Refractivity: 152.2±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 3
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 2
    ACD/LogP: 5.19
    ACD/LogD (pH 5.5): 4.79
    ACD/BCF (pH 5.5): 2571.23
    ACD/KOC (pH 5.5): 9604.32
    ACD/LogD (pH 7.4): 4.79
    ACD/BCF (pH 7.4): 2573.33
    ACD/KOC (pH 7.4): 9612.18
    Polar Surface Area: 114 Å2
    Polarizability: 60.3±0.5 10-24cm3
    Surface Tension: 48.4±7.0 dyne/cm
    Molar Volume: 424.1±7.0 cm3

    Click to predict properties on the Chemicalize site


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