ChemSpider 2D Image | CYM5442 | C23H27N3O4

CYM5442

  • Molecular FormulaC23H27N3O4
  • Average mass409.478 Da
  • Monoisotopic mass409.200165 Da
  • ChemSpider ID28189690

More details:

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

1094042-01-9 [RN]
2-({4-[5-(3,4-diethoxyphenyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl}amino)ethan-1-ol
2-({4-[5-(3,4-Diethoxyphenyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl}amino)ethanol [German] [ACD/IUPAC Name]
2-({4-[5-(3,4-Diethoxyphenyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl}amino)ethanol [ACD/IUPAC Name]
2-({4-[5-(3,4-Diéthoxyphényl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-indén-1-yl}amino)éthanol [French] [ACD/IUPAC Name]
2-(4-(5-(3,4-diethoxyphenyl)-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl amino) ethanol
CYM 5442
CYM5442
CYM-5442
Ethanol, 2-[[4-[5-(3,4-diethoxyphenyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]amino]- [ACD/Index Name]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 617.5±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 96.3±3.0 kJ/mol
    Flash Point: 327.3±34.3 °C
    Index of Refraction: 1.618
    Molar Refractivity: 112.5±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: 4.59
    ACD/LogD (pH 5.5): 1.19
    ACD/BCF (pH 5.5): 1.12
    ACD/KOC (pH 5.5): 6.79
    ACD/LogD (pH 7.4): 2.87
    ACD/BCF (pH 7.4): 53.19
    ACD/KOC (pH 7.4): 323.02
    Polar Surface Area: 90 Å2
    Polarizability: 44.6±0.5 10-24cm3
    Surface Tension: 62.7±5.0 dyne/cm
    Molar Volume: 321.1±5.0 cm3

    Click to predict properties on the Chemicalize site


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