ChemSpider 2D Image | Ethyl 4-[3-(1-cyano-2-{[2-(4-methoxyphenyl)ethyl]amino}-2-oxoethyl)-2-quinoxalinyl]-1-piperazinecarboxylate | C27H30N6O4

Ethyl 4-[3-(1-cyano-2-{[2-(4-methoxyphenyl)ethyl]amino}-2-oxoethyl)-2-quinoxalinyl]-1-piperazinecarboxylate

  • Molecular FormulaC27H30N6O4
  • Average mass502.565 Da
  • Monoisotopic mass502.232849 Da
  • ChemSpider ID2570773

More details:

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

1-Piperazinecarboxylic acid, 4-[3-[1-cyano-2-[[2-(4-methoxyphenyl)ethyl]amino]-2-oxoethyl]-2-quinoxalinyl]-, ethyl ester [ACD/Index Name]
4-[3-(1-Cyano-2-{[2-(4-méthoxyphényl)éthyl]amino}-2-oxoéthyl)-2-quinoxalinyl]-1-pipérazinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-[3-(1-cyano-2-{[2-(4-methoxyphenyl)ethyl]amino}-2-oxoethyl)-2-quinoxalinyl]-1-piperazinecarboxylate [ACD/IUPAC Name]
Ethyl-4-[3-(1-cyan-2-{[2-(4-methoxyphenyl)ethyl]amino}-2-oxoethyl)-2-chinoxalinyl]-1-piperazincarboxylat [German] [ACD/IUPAC Name]
378209-90-6 [RN]
ethyl 4-(3-(1-cyano-2-((4-methoxyphenethyl)amino)-2-oxoethyl)quinoxalin-2-yl)piperazine-1-carboxylate
ethyl 4-[3-(1-cyano-2-{[2-(4-methoxyphenyl)ethyl]amino}-2-oxoethyl)quinoxalin-2-yl]piperazine-1-carboxylate
ethyl 4-[3-(cyano{N-[2-(4-methoxyphenyl)ethyl]carbamoyl}methyl)quinoxalin-2-yl]piperazinecarboxylate
ethyl 4-[3-[1-cyano-2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl]quinoxalin-2-yl]piperazine-1-carboxylate

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 750.4±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.5 mmHg at 25°C
    Enthalpy of Vaporization: 109.4±3.0 kJ/mol
    Flash Point: 407.6±32.9 °C
    Index of Refraction: 1.616
    Molar Refractivity: 137.8±0.3 cm3
    #H bond acceptors: 10
    #H bond donors: 1
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 2
    ACD/LogP: 1.46
    ACD/LogD (pH 5.5):
    ACD/BCF (pH 5.5):
    ACD/KOC (pH 5.5):
    ACD/LogD (pH 7.4):
    ACD/BCF (pH 7.4):
    ACD/KOC (pH 7.4):
    Polar Surface Area: 121 Å2
    Polarizability: 54.6±0.5 10-24cm3
    Surface Tension: 60.5±3.0 dyne/cm
    Molar Volume: 394.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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