ChemSpider 2D Image | [1-(4,6-Dimethyl-2-pyrimidinyl)-4-piperidinyl]{4-[(2E)-3-phenyl-2-propen-1-yl]-1-piperazinyl}methanone | C25H33N5O

[1-(4,6-Dimethyl-2-pyrimidinyl)-4-piperidinyl]{4-[(2E)-3-phenyl-2-propen-1-yl]-1-piperazinyl}methanone

  • Molecular FormulaC25H33N5O
  • Average mass419.562 Da
  • Monoisotopic mass419.268524 Da
  • ChemSpider ID29347792

  • Double-bond stereo - Double-bond stereo

More details:

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

[1-(4,6-Dimethyl-2-pyrimidinyl)-4-piperidinyl]{4-[(2E)-3-phenyl-2-propen-1-yl]-1-piperazinyl}methanon [German] [ACD/IUPAC Name]
[1-(4,6-Dimethyl-2-pyrimidinyl)-4-piperidinyl]{4-[(2E)-3-phenyl-2-propen-1-yl]-1-piperazinyl}methanone [ACD/IUPAC Name]
[1-(4,6-Diméthyl-2-pyrimidinyl)-4-pipéridinyl]{4-[(2E)-3-phényl-2-propén-1-yl]-1-pipérazinyl}méthanone [French] [ACD/IUPAC Name]
Methanone, [1-(4,6-dimethyl-2-pyrimidinyl)-4-piperidinyl][4-[(2E)-3-phenyl-2-propen-1-yl]-1-piperazinyl]- [ACD/Index Name]
[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methanone
[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}methanone
1401612-29-0 [RN]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 644.9±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 95.1±3.0 kJ/mol
    Flash Point: 343.8±34.3 °C
    Index of Refraction: 1.606
    Molar Refractivity: 125.2±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 4.11
    ACD/LogD (pH 5.5): 2.02
    ACD/BCF (pH 5.5): 7.24
    ACD/KOC (pH 5.5): 42.78
    ACD/LogD (pH 7.4): 3.78
    ACD/BCF (pH 7.4): 414.77
    ACD/KOC (pH 7.4): 2449.70
    Polar Surface Area: 53 Å2
    Polarizability: 49.6±0.5 10-24cm3
    Surface Tension: 52.4±3.0 dyne/cm
    Molar Volume: 363.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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