ChemSpider 2D Image | N'-[(1E)-3-(1,3-Benzodioxol-5-yl)-2-methylpropylidene]-2-(3-butoxyphenyl)-4-quinolinecarbohydrazide | C31H31N3O4

N'-[(1E)-3-(1,3-Benzodioxol-5-yl)-2-methylpropylidene]-2-(3-butoxyphenyl)-4-quinolinecarbohydrazide

  • Molecular FormulaC31H31N3O4
  • Average mass509.595 Da
  • Monoisotopic mass509.231445 Da
  • ChemSpider ID7925885

  • Double-bond stereo - Double-bond stereo

More details:

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

4-Quinolinecarboxylic acid, 2-(3-butoxyphenyl)-, 2-[(1E)-3-(1,3-benzodioxol-5-yl)-2-methylpropylidene]hydrazide [ACD/Index Name]
N'-[(1E)-3-(1,3-Benzodioxol-5-yl)-2-methylpropyliden]-2-(3-butoxyphenyl)-4-chinolincarbohydrazid [German] [ACD/IUPAC Name]
N'-[(1E)-3-(1,3-Benzodioxol-5-yl)-2-méthylpropylidène]-2-(3-butoxyphényl)-4-quinoléinecarbohydrazide [French] [ACD/IUPAC Name]
N'-[(1E)-3-(1,3-Benzodioxol-5-yl)-2-methylpropylidene]-2-(3-butoxyphenyl)-4-quinolinecarbohydrazide [ACD/IUPAC Name]
2-(3-Butoxy-phenyl)-quinoline-4-carboxylic acid (3-benzo[1,3]dioxol-5-yl-2-methyl-propylidene)-hydrazide
445240-72-2 [RN]
MFCD02244514
N-((1E)-4-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)-3-methyl-1-azabut-1-enyl)[2-(3-butoxyphenyl)(4-quinolyl)]carboxamide
N'-[(1E)-3-(1,3-benzodioxol-5-yl)-2-methylpropylidene]-2-(3-butoxyphenyl)quinoline-4-carbohydrazide
N-[(E)-[3-(1,3-benzodioxol-5-yl)-2-methylpropylidene]amino]-2-(3-butoxyphenyl)quinoline-4-carboxamide
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AK-968/41025339 [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.619
    Molar Refractivity: 146.5±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 2
    ACD/LogP: 7.03
    ACD/LogD (pH 5.5): 5.61
    ACD/BCF (pH 5.5): 10875.24
    ACD/KOC (pH 5.5): 26896.84
    ACD/LogD (pH 7.4): 5.62
    ACD/BCF (pH 7.4): 10975.51
    ACD/KOC (pH 7.4): 27144.84
    Polar Surface Area: 82 Å2
    Polarizability: 58.1±0.5 10-24cm3
    Surface Tension: 45.6±7.0 dyne/cm
    Molar Volume: 417.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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