ChemSpider 2D Image | 2-[3-(4-Fluorophenyl)-5-methyl-1H-pyrazol-4-yl]-N-[3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]acetamide | C22H23FN6OS

2-[3-(4-Fluorophenyl)-5-methyl-1H-pyrazol-4-yl]-N-[3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]acetamide

  • Molecular FormulaC22H23FN6OS
  • Average mass438.521 Da
  • Monoisotopic mass438.163818 Da
  • ChemSpider ID32079907

More details:

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

1H-Pyrazole-4-acetamide, 3-(4-fluorophenyl)-5-methyl-N-[3-(methylthio)-1-(1,2,4-triazolo[4,3-a]pyridin-3-yl)propyl]- [ACD/Index Name]
2-[3-(4-Fluorophenyl)-5-methyl-1H-pyrazol-4-yl]-N-[3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]acetamide [ACD/IUPAC Name]
2-[3-(4-Fluorophényl)-5-méthyl-1H-pyrazol-4-yl]-N-[3-(méthylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]acétamide [French] [ACD/IUPAC Name]
2-[3-(4-Fluorphenyl)-5-methyl-1H-pyrazol-4-yl]-N-[3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]acetamid [German] [ACD/IUPAC Name]
2-[3-(4-fluorophenyl)-5-methyl-1H-pyrazol-4-yl]-N-[3-methylsulfanyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]acetamide

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

    Density: 1.4±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.682
    Molar Refractivity: 121.1±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 3.11
    ACD/LogD (pH 5.5): 2.94
    ACD/BCF (pH 5.5): 101.78
    ACD/KOC (pH 5.5): 951.19
    ACD/LogD (pH 7.4): 2.95
    ACD/BCF (pH 7.4): 102.11
    ACD/KOC (pH 7.4): 954.33
    Polar Surface Area: 113 Å2
    Polarizability: 48.0±0.5 10-24cm3
    Surface Tension: 51.8±7.0 dyne/cm
    Molar Volume: 319.7±7.0 cm3

    Click to predict properties on the Chemicalize site


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