ChemSpider 2D Image | N-(1,3-Benzodioxol-5-ylmethyl)-2-imino-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide | C28H31N5O4

N-(1,3-Benzodioxol-5-ylmethyl)-2-imino-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide

  • Molecular FormulaC28H31N5O4
  • Average mass501.577 Da
  • Monoisotopic mass501.237610 Da
  • ChemSpider ID21525196

More details:

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

2H-Dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1,5-dihydro-2-imino-1-octyl-5-oxo- [ACD/Index Name]
N-(1,3-Benzodioxol-5-ylmethyl)-2-imino-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-3-carboxamid [German] [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylmethyl)-2-imino-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylméthyl)-2-imino-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide [French] [ACD/IUPAC Name]
2-Imino-1-octyl-10-oxo-1,10-dihydro-2H-1,9,10a-triaza-anthracene-3-carboxylic acid (benzo[1,3]dioxol-5-ylmethyl)-amide
844859-50-3 [RN]
N-(1,3-benzodioxol-5-ylmethyl)-2-imino-1-octyl-5-oxodipyrido[1,2-d:3',4'-f]pyrimidine-3-carboxamide
N-(2H-benzo[3,4-d]1,3-dioxolan-5-ylmethyl)(2-imino-1-octyl-5-oxo(1,6-dihydropyridino[1,2-a]pyridino[2,3-d]pyrimidin-3-yl))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:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.665
    Molar Refractivity: 139.1±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 2
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 1
    ACD/LogP: 3.27
    ACD/LogD (pH 5.5): 1.52
    ACD/BCF (pH 5.5): 3.36
    ACD/KOC (pH 5.5): 27.94
    ACD/LogD (pH 7.4): 2.88
    ACD/BCF (pH 7.4): 76.08
    ACD/KOC (pH 7.4): 632.23
    Polar Surface Area: 107 Å2
    Polarizability: 55.1±0.5 10-24cm3
    Surface Tension: 54.7±7.0 dyne/cm
    Molar Volume: 374.6±7.0 cm3

    Click to predict properties on the Chemicalize site


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