ChemSpider 2D Image | 3-Methoxy-N-[(4-methyl-5-{[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]benzamide | C24H28N6O3S

3-Methoxy-N-[(4-methyl-5-{[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]benzamide

  • Molecular FormulaC24H28N6O3S
  • Average mass480.582 Da
  • Monoisotopic mass480.194366 Da
  • ChemSpider ID21117077

More details:

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

3-Methoxy-N-[(4-methyl-5-{[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]benzamid [German] [ACD/IUPAC Name]
3-Methoxy-N-[(4-methyl-5-{[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]benzamide [ACD/IUPAC Name]
3-Méthoxy-N-[(4-méthyl-5-{[2-oxo-2-(4-phényl-1-pipérazinyl)éthyl]sulfanyl}-4H-1,2,4-triazol-3-yl)méthyl]benzamide [French] [ACD/IUPAC Name]
Benzamide, 3-methoxy-N-[[4-methyl-5-[[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]thio]-4H-1,2,4-triazol-3-yl]methyl]- [ACD/Index Name]
3-methoxy-N-[(4-methyl-5-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]benzamide
3-methoxy-N-[[4-methyl-5-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide
948823-48-1 [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:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.659
    Molar Refractivity: 134.5±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 1
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 1.95
    ACD/LogD (pH 5.5): 2.03
    ACD/BCF (pH 5.5): 20.54
    ACD/KOC (pH 5.5): 302.52
    ACD/LogD (pH 7.4): 2.03
    ACD/BCF (pH 7.4): 20.60
    ACD/KOC (pH 7.4): 303.41
    Polar Surface Area: 118 Å2
    Polarizability: 53.3±0.5 10-24cm3
    Surface Tension: 53.9±7.0 dyne/cm
    Molar Volume: 364.8±7.0 cm3

    Click to predict properties on the Chemicalize site


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