ChemSpider 2D Image | 4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-5-amine | C12H10ClN5OS

4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-5-amine

  • Molecular FormulaC12H10ClN5OS
  • Average mass307.759 Da
  • Monoisotopic mass307.029449 Da
  • ChemSpider ID25980981

More details:

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

1H-Pyrazol-5-amine, 4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(methylthio)- [ACD/Index Name]
4-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-5-amine [ACD/IUPAC Name]
4-[3-(4-Chlorophényl)-1,2,4-oxadiazol-5-yl]-3-(méthylsulfanyl)-1H-pyrazol-5-amine [French] [ACD/IUPAC Name]
4-[3-(4-Chlorphenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-5-amin [German] [ACD/IUPAC Name]
1188304-96-2 [RN]
4-(3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl)-3-(methylthio)-1H-pyrazol-5-amine
4-[3-(4-Chloro-phenyl)-[1,2,4]oxadiazol-5-yl]-5-methylsulfanyl-2H-pyrazol-3-ylamine
4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-5-(methylsulfanyl)-1H-pyrazol-3-amine
MFCD18799934

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 579.0±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 86.6±3.0 kJ/mol
    Flash Point: 304.0±32.9 °C
    Index of Refraction: 1.722
    Molar Refractivity: 77.1±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 3
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 4.87
    ACD/LogD (pH 5.5): 3.25
    ACD/BCF (pH 5.5): 172.48
    ACD/KOC (pH 5.5): 1388.86
    ACD/LogD (pH 7.4): 3.24
    ACD/BCF (pH 7.4): 171.82
    ACD/KOC (pH 7.4): 1383.56
    Polar Surface Area: 119 Å2
    Polarizability: 30.5±0.5 10-24cm3
    Surface Tension: 95.4±5.0 dyne/cm
    Molar Volume: 194.7±5.0 cm3

    Click to predict properties on the Chemicalize site


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