ChemSpider 2D Image | N-Ethyl-N-{[6-(1-phenylpropyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}ethanamine | C17H23N5S

N-Ethyl-N-{[6-(1-phenylpropyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}ethanamine

  • Molecular FormulaC17H23N5S
  • Average mass329.463 Da
  • Monoisotopic mass329.167419 Da
  • ChemSpider ID26033898

More details:

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

1,2,4-Triazolo[3,4-b][1,3,4]thiadiazole-3-methanamine, N,N-diethyl-6-(1-phenylpropyl)- [ACD/Index Name]
N-Ethyl-N-{[6-(1-phenylpropyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}ethanamin [German] [ACD/IUPAC Name]
N-Ethyl-N-{[6-(1-phenylpropyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}ethanamine [ACD/IUPAC Name]
N-Éthyl-N-{[6-(1-phénylpropyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]méthyl}éthanamine [French] [ACD/IUPAC Name]
1313833-10-1 [RN]
diethyl({[6-(1-phenylpropyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl})amine
diethyl{[6-(1-phenylpropyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}amine
N-ethyl-N-[[6-(1-phenylpropyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl]ethanamine

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

    Density: 1.2±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.647
    Molar Refractivity: 97.6±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 4.23
    ACD/LogD (pH 5.5): 1.19
    ACD/BCF (pH 5.5): 1.28
    ACD/KOC (pH 5.5): 8.82
    ACD/LogD (pH 7.4): 2.90
    ACD/BCF (pH 7.4): 65.26
    ACD/KOC (pH 7.4): 449.80
    Polar Surface Area: 75 Å2
    Polarizability: 38.7±0.5 10-24cm3
    Surface Tension: 46.5±7.0 dyne/cm
    Molar Volume: 268.3±7.0 cm3

    Click to predict properties on the Chemicalize site


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