ChemSpider 2D Image | 1-(4-Fluorobenzyl)-N-[1-(2-{4-[(~2~H_3_)methyloxy]phenyl}ethyl)-4-piperidinyl]-1H-benzimidazol-2-amine | C28H28D3FN4O

1-(4-Fluorobenzyl)-N-[1-(2-{4-[(2H3)methyloxy]phenyl}ethyl)-4-piperidinyl]-1H-benzimidazol-2-amine

  • Molecular FormulaC28H28D3FN4O
  • Average mass461.589 Da
  • Monoisotopic mass461.267029 Da
  • ChemSpider ID28559241

  • Non-standard isotope - Non-standard isotope

More details:

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

1-(4-Fluorbenzyl)-N-[1-(2-{4-[(2H3)methyloxy]phenyl}ethyl)-4-piperidinyl]-1H-benzimidazol-2-amin [German] [ACD/IUPAC Name]
1-(4-Fluorobenzyl)-N-[1-(2-{4-[(2H3)methyloxy]phenyl}ethyl)-4-piperidinyl]-1H-benzimidazol-2-amine [ACD/IUPAC Name]
1-(4-Fluorobenzyl)-N-[1-(2-{4-[(2H3)méthyloxy]phényl}éthyl)-4-pipéridinyl]-1H-benzimidazol-2-amine [French] [ACD/IUPAC Name]
1H-Benzimidazol-2-amine, 1-[(4-fluorophenyl)methyl]-N-[1-[2-[4-(methyl-d3-oxy)phenyl]ethyl]-4-piperidinyl]- [ACD/Index Name]
1-[(4-Fluorophenyl)methyl]-N-[1-(2-{4-[(2H3)methyloxy]phenyl}ethyl)piperidin-4-yl]-1H-benzimidazol-2-amine
1-[(4-fluorophenyl)methyl]-N-[1-[2-[4-(trideuteriomethoxy)phenyl]ethyl]piperidin-4-yl]benzimidazol-2-amine
1189961-39-4 [RN]
ASTEMIZOLE-D3

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 627.3±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 92.8±3.0 kJ/mol
    Flash Point: 333.2±34.3 °C
    Index of Refraction: 1.623
    Molar Refractivity: 133.9±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 1
    ACD/LogP: 5.80
    ACD/LogD (pH 5.5): 2.26
    ACD/BCF (pH 5.5): 4.79
    ACD/KOC (pH 5.5): 11.72
    ACD/LogD (pH 7.4): 4.24
    ACD/BCF (pH 7.4): 458.31
    ACD/KOC (pH 7.4): 1122.13
    Polar Surface Area: 42 Å2
    Polarizability: 53.1±0.5 10-24cm3
    Surface Tension: 44.5±7.0 dyne/cm
    Molar Volume: 379.8±7.0 cm3

    Click to predict properties on the Chemicalize site


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