ChemSpider 2D Image | 4-Amino-2-(3-bromophenyl)-1,2-dihydropyrimido[1,2-a]benzimidazole-3-carbonitrile | C17H12BrN5

4-Amino-2-(3-bromophenyl)-1,2-dihydropyrimido[1,2-a]benzimidazole-3-carbonitrile

  • Molecular FormulaC17H12BrN5
  • Average mass366.215 Da
  • Monoisotopic mass365.027588 Da
  • ChemSpider ID21860823

More details:

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

4-Amino-2-(3-bromophenyl)-1,2-dihydropyrimido[1,2-a]benzimidazole-3-carbonitrile [ACD/IUPAC Name]
4-Amino-2-(3-bromophényl)-1,2-dihydropyrimido[1,2-a]benzimidazole-3-carbonitrile [French] [ACD/IUPAC Name]
4-Amino-2-(3-bromphenyl)-1,2-dihydropyrimido[1,2-a]benzimidazol-3-carbonitril [German] [ACD/IUPAC Name]
Pyrimido[1,2-a]benzimidazole-3-carbonitrile, 4-amino-2-(3-bromophenyl)-1,2-dihydro- [ACD/Index Name]
1021268-61-0 [RN]
4-Amino-2-(3-bromo-phenyl)-1,2-dihydro-benzo[4,5]imidazo[1,2-a]pyrimidine-3-carbonitrile
4-amino-2-(3-bromophenyl)-2,10-dihydropyrimido[1,2-a]benzimidazole-3-carbonitrile

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

    Density: 1.7±0.1 g/cm3
    Boiling Point: 632.5±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 93.5±3.0 kJ/mol
    Flash Point: 336.3±34.3 °C
    Index of Refraction: 1.785
    Molar Refractivity: 92.1±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 3
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 4.43
    ACD/LogD (pH 5.5): 3.88
    ACD/BCF (pH 5.5): 503.76
    ACD/KOC (pH 5.5): 2878.44
    ACD/LogD (pH 7.4): 3.93
    ACD/BCF (pH 7.4): 575.69
    ACD/KOC (pH 7.4): 3289.44
    Polar Surface Area: 80 Å2
    Polarizability: 36.5±0.5 10-24cm3
    Surface Tension: 66.1±7.0 dyne/cm
    Molar Volume: 218.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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