ChemSpider 2D Image | N-[2-(6-{(Z)-[1-(4-Ethylphenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene]methyl}-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-N-methylbenzamide | C31H29N3O7

N-[2-(6-{(Z)-[1-(4-Ethylphenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene]methyl}-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-N-methylbenzamide

  • Molecular FormulaC31H29N3O7
  • Average mass555.578 Da
  • Monoisotopic mass555.200562 Da
  • ChemSpider ID17462936

  • Double-bond stereo - Double-bond stereo

More details:

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

Benzamide, N-[2-[6-[(Z)-[1-(4-ethylphenyl)tetrahydro-2,4,6-trioxo-5(2H)-pyrimidinylidene]methyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-N-methyl- [ACD/Index Name]
N-[2-(6-{(Z)-[1-(4-Ethylphenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinyliden]methyl}-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-N-methylbenzamid [German] [ACD/IUPAC Name]
N-[2-(6-{(Z)-[1-(4-Ethylphenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene]methyl}-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-N-methylbenzamide [ACD/IUPAC Name]
N-[2-(6-{(Z)-[1-(4-Éthylphényl)-2,4,6-trioxotétrahydro-5(2H)-pyrimidinylidène]méthyl}-7-méthoxy-1,3-benzodioxol-5-yl)éthyl]-N-méthylbenzamide [French] [ACD/IUPAC Name]
370585-84-5 [RN]
MolPort-000-818-283
MolPort-002-514-963
N-[2-[6-[(Z)-[1-(4-ethylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-N-methylbenzamide
STOCK1N-28501

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

    Density: 1.3±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.646
    Molar Refractivity: 150.7±0.3 cm3
    #H bond acceptors: 10
    #H bond donors: 1
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 2
    ACD/LogP: 4.43
    ACD/LogD (pH 5.5): 2.99
    ACD/BCF (pH 5.5): 110.12
    ACD/KOC (pH 5.5): 998.74
    ACD/LogD (pH 7.4): 2.48
    ACD/BCF (pH 7.4): 33.65
    ACD/KOC (pH 7.4): 305.23
    Polar Surface Area: 114 Å2
    Polarizability: 59.8±0.5 10-24cm3
    Surface Tension: 58.8±3.0 dyne/cm
    Molar Volume: 415.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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