ChemSpider 2D Image | Ethyl 4-[({[1-(2-chlorobenzyl)-1H-indol-3-yl]sulfonyl}acetyl)amino]benzoate | C26H23ClN2O5S

Ethyl 4-[({[1-(2-chlorobenzyl)-1H-indol-3-yl]sulfonyl}acetyl)amino]benzoate

  • Molecular FormulaC26H23ClN2O5S
  • Average mass510.989 Da
  • Monoisotopic mass510.101624 Da
  • ChemSpider ID1614553

More details:

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

4-[(2-{[1-(2-Chlorobenzyl)-1H-indol-3-yl]sulfonyl}acétyl)amino]benzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[[2-[[1-[(2-chlorophenyl)methyl]-1H-indol-3-yl]sulfonyl]acetyl]amino]-, ethyl ester [ACD/Index Name]
Ethyl 4-[({[1-(2-chlorobenzyl)-1H-indol-3-yl]sulfonyl}acetyl)amino]benzoate [ACD/IUPAC Name]
Ethyl-4-[({[1-(2-chlorbenzyl)-1H-indol-3-yl]sulfonyl}acetyl)amino]benzoat [German] [ACD/IUPAC Name]
686748-99-2 [RN]
ethyl 4-(2-((1-(2-chlorobenzyl)-1H-indol-3-yl)sulfonyl)acetamido)benzoate
ethyl 4-[[2-[1-[(2-chlorophenyl)methyl]indol-3-yl]sulfonylacetyl]amino]benzoate
ethyl 4-[2-({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfonyl)acetamido]benzoate

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 789.2±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.8 mmHg at 25°C
    Enthalpy of Vaporization: 114.8±3.0 kJ/mol
    Flash Point: 431.1±32.9 °C
    Index of Refraction: 1.633
    Molar Refractivity: 136.5±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 2
    ACD/LogP: 5.70
    ACD/LogD (pH 5.5): 5.01
    ACD/BCF (pH 5.5): 3792.75
    ACD/KOC (pH 5.5): 12688.47
    ACD/LogD (pH 7.4): 5.01
    ACD/BCF (pH 7.4): 3792.56
    ACD/KOC (pH 7.4): 12687.84
    Polar Surface Area: 103 Å2
    Polarizability: 54.1±0.5 10-24cm3
    Surface Tension: 52.1±7.0 dyne/cm
    Molar Volume: 381.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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