ChemSpider 2D Image | N-(2,6-Dimethylphenyl)-1-{[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl](phenyl)amino}cyclohexanecarboxamide | C31H31N3O4

N-(2,6-Dimethylphenyl)-1-{[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl](phenyl)amino}cyclohexanecarboxamide

  • Molecular FormulaC31H31N3O4
  • Average mass509.595 Da
  • Monoisotopic mass509.231445 Da
  • ChemSpider ID3170124

More details:

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

2H-Isoindole-2-acetamide, N-[1-[[(2,6-dimethylphenyl)amino]carbonyl]cyclohexyl]-1,3-dihydro-1,3-dioxo-N-phenyl- [ACD/Index Name]
N-(2,6-Dimethylphenyl)-1-{[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl](phenyl)amino}cyclohexancarboxamid [German] [ACD/IUPAC Name]
N-(2,6-Dimethylphenyl)-1-{[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl](phenyl)amino}cyclohexanecarboxamide [ACD/IUPAC Name]
N-(2,6-Diméthylphényl)-1-{[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acétyl](phényl)amino}cyclohexanecarboxamide [French] [ACD/IUPAC Name]
1-{[2-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-acetyl]-phenyl-amino}-cyclohexanecarboxylic acid (2,6-dimethyl-phenyl)-amide
443905-07-5 [RN]
N-(2,6-dimethylphenyl)-1-(N-[2-(1,3-dioxoisoindol-2-yl)acetyl]anilino)cyclohexane-1-carboxamide

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 689.4±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 101.1±3.0 kJ/mol
    Flash Point: 370.8±31.5 °C
    Index of Refraction: 1.664
    Molar Refractivity: 145.2±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 2
    ACD/LogP: 5.93
    ACD/LogD (pH 5.5): 4.63
    ACD/BCF (pH 5.5): 1940.15
    ACD/KOC (pH 5.5): 7852.40
    ACD/LogD (pH 7.4): 4.63
    ACD/BCF (pH 7.4): 1940.57
    ACD/KOC (pH 7.4): 7854.11
    Polar Surface Area: 87 Å2
    Polarizability: 57.6±0.5 10-24cm3
    Surface Tension: 63.5±3.0 dyne/cm
    Molar Volume: 391.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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