ChemSpider 2D Image | 1-{7-[(E)-2-(Dimethylamino)vinyl]-2-(ethylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}ethanone | C13H17N5OS

1-{7-[(E)-2-(Dimethylamino)vinyl]-2-(ethylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}ethanone

  • Molecular FormulaC13H17N5OS
  • Average mass291.372 Da
  • Monoisotopic mass291.115387 Da
  • ChemSpider ID26457738

  • Double-bond stereo - Double-bond stereo

More details:

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

1-{7-[(E)-2-(Dimethylamino)vinyl]-2-(ethylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}ethanon [German] [ACD/IUPAC Name]
1-{7-[(E)-2-(Dimethylamino)vinyl]-2-(ethylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}ethanone [ACD/IUPAC Name]
1-{7-[(E)-2-(Diméthylamino)vinyl]-2-(éthylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[7-[(E)-2-(dimethylamino)ethenyl]-2-(ethylthio)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]- [ACD/Index Name]
1-[7-(2-Dimethylamino-vinyl)-2-ethylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-ethanone
1-[7-[(E)-2-(dimethylamino)-1-ethenyl]-2-(ethylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-ethanone
1-[7-[(E)-2-(dimethylamino)ethenyl]-2-ethylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethanone
1-[7-[(E)-2-(dimethylamino)vinyl]-2-(ethylthio)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethanone
1-[7-[(E)-2-(Dimethylamino)vinyl]-2-(ethylthio)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethanone
1-{7-[(E)-2-(dimethylamino)ethenyl]-2-(ethylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}ethanone
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    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: 1.639
    Molar Refractivity: 82.4±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.71
    ACD/LogD (pH 5.5): 0.92
    ACD/BCF (pH 5.5): 1.92
    ACD/KOC (pH 5.5): 33.29
    ACD/LogD (pH 7.4): 1.68
    ACD/BCF (pH 7.4): 10.95
    ACD/KOC (pH 7.4): 189.47
    Polar Surface Area: 89 Å2
    Polarizability: 32.6±0.5 10-24cm3
    Surface Tension: 47.0±7.0 dyne/cm
    Molar Volume: 228.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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