ChemSpider 2D Image | N-[2-(5-Chloro-1H-indol-3-yl)ethyl]-5-[(2-fluorobenzyl)oxy]-4-oxo-4H-pyran-2-carboxamide | C23H18ClFN2O4

N-[2-(5-Chloro-1H-indol-3-yl)ethyl]-5-[(2-fluorobenzyl)oxy]-4-oxo-4H-pyran-2-carboxamide

  • Molecular FormulaC23H18ClFN2O4
  • Average mass440.851 Da
  • Monoisotopic mass440.093903 Da
  • ChemSpider ID26046407

More details:

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

4H-Pyran-2-carboxamide, N-[2-(5-chloro-1H-indol-3-yl)ethyl]-5-[(2-fluorophenyl)methoxy]-4-oxo- [ACD/Index Name]
N-[2-(5-Chlor-1H-indol-3-yl)ethyl]-5-[(2-fluorbenzyl)oxy]-4-oxo-4H-pyran-2-carboxamid [German] [ACD/IUPAC Name]
N-[2-(5-Chloro-1H-indol-3-yl)ethyl]-5-[(2-fluorobenzyl)oxy]-4-oxo-4H-pyran-2-carboxamide [ACD/IUPAC Name]
N-[2-(5-Chloro-1H-indol-3-yl)éthyl]-5-[(2-fluorobenzyl)oxy]-4-oxo-4H-pyrane-2-carboxamide [French] [ACD/IUPAC Name]
1190249-77-4 [RN]
N-[2-(5-chloro-1H-indol-3-yl)ethyl]-5-[(2-fluorophenyl)methoxy]-4-oxopyran-2-carboxamide

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

    Density: 1.4±0.1 g/cm3
    Boiling Point: 763.4±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.6 mmHg at 25°C
    Enthalpy of Vaporization: 111.2±3.0 kJ/mol
    Flash Point: 415.5±32.9 °C
    Index of Refraction: 1.668
    Molar Refractivity: 114.3±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 3.17
    ACD/LogD (pH 5.5): 3.25
    ACD/BCF (pH 5.5): 173.63
    ACD/KOC (pH 5.5): 1395.49
    ACD/LogD (pH 7.4): 3.25
    ACD/BCF (pH 7.4): 173.63
    ACD/KOC (pH 7.4): 1395.49
    Polar Surface Area: 80 Å2
    Polarizability: 45.3±0.5 10-24cm3
    Surface Tension: 63.8±5.0 dyne/cm
    Molar Volume: 306.6±5.0 cm3

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