ChemSpider 2D Image | 1-(1-Azepanyl)-2-{4-[(6-fluoro-1H-indol-1-yl)acetyl]-1-piperazinyl}ethanone | C22H29FN4O2

1-(1-Azepanyl)-2-{4-[(6-fluoro-1H-indol-1-yl)acetyl]-1-piperazinyl}ethanone

  • Molecular FormulaC22H29FN4O2
  • Average mass400.490 Da
  • Monoisotopic mass400.227448 Da
  • ChemSpider ID23495068

More details:

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

1-(1-Azepanyl)-2-{4-[(6-fluor-1H-indol-1-yl)acetyl]-1-piperazinyl}ethanon [German] [ACD/IUPAC Name]
1-(1-Azepanyl)-2-{4-[(6-fluoro-1H-indol-1-yl)acetyl]-1-piperazinyl}ethanone [ACD/IUPAC Name]
1-(1-Azépanyl)-2-{4-[2-(6-fluoro-1H-indol-1-yl)acétyl]-1-pipérazinyl}éthanone [French] [ACD/IUPAC Name]
Ethanone, 2-(6-fluoro-1H-indol-1-yl)-1-[4-[2-(hexahydro-1H-azepin-1-yl)-2-oxoethyl]-1-piperazinyl]- [ACD/Index Name]
1-(2-{4-[2-(1-azepanyl)-2-oxoethyl]-1-piperazinyl}-2-oxoethyl)-6-fluoro-1H-indole
1-(azepan-1-yl)-2-[4-[2-(6-fluoroindol-1-yl)acetyl]piperazin-1-yl]ethanone
1-(azepan-1-yl)-2-{4-[(6-fluoro-1H-indol-1-yl)acetyl]piperazin-1-yl}ethanone
1-[4-(2-Azepan-1-yl-2-oxo-ethyl)-piperazin-1-yl]-2-(6-fluoro-indol-1-yl)-ethanone
1144488-94-7 [RN]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 618.2±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 91.7±3.0 kJ/mol
    Flash Point: 327.7±31.5 °C
    Index of Refraction: 1.628
    Molar Refractivity: 111.1±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.47
    ACD/LogD (pH 5.5): 2.34
    ACD/BCF (pH 5.5): 34.52
    ACD/KOC (pH 5.5): 425.13
    ACD/LogD (pH 7.4): 2.39
    ACD/BCF (pH 7.4): 38.61
    ACD/KOC (pH 7.4): 475.53
    Polar Surface Area: 49 Å2
    Polarizability: 44.1±0.5 10-24cm3
    Surface Tension: 50.0±7.0 dyne/cm
    Molar Volume: 313.1±7.0 cm3

    Click to predict properties on the Chemicalize site


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