ChemSpider 2D Image | 2-Amino-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(3,4,5-trimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide | C30H31N5O6

2-Amino-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(3,4,5-trimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

  • Molecular FormulaC30H31N5O6
  • Average mass557.597 Da
  • Monoisotopic mass557.227417 Da
  • ChemSpider ID1303174

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-dimethoxyphenyl)ethyl]-1-(3,4,5-trimethoxyphenyl)- [ACD/Index Name]
2-Amino-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(3,4,5-trimethoxyphenyl)-1H-pyrrolo[2,3-b]chinoxalin-3-carboxamid [German] [ACD/IUPAC Name]
2-Amino-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(3,4,5-trimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide [ACD/IUPAC Name]
2-Amino-N-[2-(3,4-diméthoxyphényl)éthyl]-1-(3,4,5-triméthoxyphényl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide [French] [ACD/IUPAC Name]
2-AMINO-N-[2-(3,4-DIMETHOXYPHENYL)ETHYL]-1-(3,4,5-TRIMETHOXYPHENYL)PYRROLO[2,3-B]QUINOXALINE-3-CARBOXAMIDE
2-amino-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(3,4,5-trimethoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide
378201-89-9 [RN]

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

ZINC01876473 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 729.8±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.4 mmHg at 25°C
    Enthalpy of Vaporization: 106.5±3.0 kJ/mol
    Flash Point: 395.2±32.9 °C
    Index of Refraction: 1.634
    Molar Refractivity: 150.0±0.5 cm3
    #H bond acceptors: 11
    #H bond donors: 3
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 2
    ACD/LogP: 3.12
    ACD/LogD (pH 5.5): 3.37
    ACD/BCF (pH 5.5): 214.12
    ACD/KOC (pH 5.5): 1621.07
    ACD/LogD (pH 7.4): 3.37
    ACD/BCF (pH 7.4): 214.25
    ACD/KOC (pH 7.4): 1622.10
    Polar Surface Area: 132 Å2
    Polarizability: 59.5±0.5 10-24cm3
    Surface Tension: 48.0±7.0 dyne/cm
    Molar Volume: 419.2±7.0 cm3

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