ChemSpider 2D Image | [5-(1,3-Benzodioxol-5-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl][4-(diphenylmethyl)-1-piperazinyl]methanone | C32H30F3N5O3

[5-(1,3-Benzodioxol-5-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl][4-(diphenylmethyl)-1-piperazinyl]methanone

  • Molecular FormulaC32H30F3N5O3
  • Average mass589.607 Da
  • Monoisotopic mass589.230103 Da
  • ChemSpider ID21340762

More details:

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

[5-(1,3-Benzodioxol-5-yl)-7-(trifluormethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl][4-(diphenylmethyl)-1-piperazinyl]methanon [German] [ACD/IUPAC Name]
[5-(1,3-Benzodioxol-5-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl][4-(diphenylmethyl)-1-piperazinyl]methanone [ACD/IUPAC Name]
[5-(1,3-Benzodioxol-5-yl)-7-(trifluorométhyl)-4,5,6,7-tétrahydropyrazolo[1,5-a]pyrimidin-3-yl][4-(diphénylméthyl)-1-pipérazinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, [5-(1,3-benzodioxol-5-yl)-4,5,6,7-tetrahydro-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl][4-(diphenylmethyl)-1-piperazinyl]- [ACD/Index Name]
(4-benzhydrylpiperazin-1-yl)(5-(benzo[d][1,3]dioxol-5-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl)methanone
(4-BENZHYDRYLPIPERAZIN-1-YL)-[5-(1,3-BENZODIOXOL-5-YL)-7-(TRIFLUOROMETHYL)-4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRIMIDIN-3-YL]METHANONE
[5-(1,3-benzodioxol-5-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl][4-(diphenylmethyl)piperazin-1-yl]methanone
351894-65-0 [RN]
5-(1,3-benzodioxol-5-yl)-3-{[4-(diphenylmethyl)-1-piperazinyl]carbonyl}-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine
ZINC01213048

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 706.9±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 103.4±3.0 kJ/mol
    Flash Point: 381.3±32.9 °C
    Index of Refraction: 1.668
    Molar Refractivity: 153.9±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 1
    ACD/LogP: 4.97
    ACD/LogD (pH 5.5): 4.34
    ACD/BCF (pH 5.5): 1064.26
    ACD/KOC (pH 5.5): 4579.50
    ACD/LogD (pH 7.4): 4.50
    ACD/BCF (pH 7.4): 1555.15
    ACD/KOC (pH 7.4): 6691.75
    Polar Surface Area: 72 Å2
    Polarizability: 61.0±0.5 10-24cm3
    Surface Tension: 51.6±7.0 dyne/cm
    Molar Volume: 413.2±7.0 cm3

    Click to predict properties on the Chemicalize site


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