ChemSpider 2D Image | 6-(5-Methyl-1,2-oxazol-3-yl)-3-(1-methyl-1H-pyrazol-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole | C11H9N7OS

6-(5-Methyl-1,2-oxazol-3-yl)-3-(1-methyl-1H-pyrazol-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

  • Molecular FormulaC11H9N7OS
  • Average mass287.301 Da
  • Monoisotopic mass287.058929 Da
  • ChemSpider ID29344475

More details:

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

1,2,4-Triazolo[3,4-b][1,3,4]thiadiazole, 6-(5-methyl-3-isoxazolyl)-3-(1-methyl-1H-pyrazol-4-yl)- [ACD/Index Name]
6-(5-Methyl-1,2-oxazol-3-yl)-3-(1-methyl-1H-pyrazol-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol [German] [ACD/IUPAC Name]
6-(5-Methyl-1,2-oxazol-3-yl)-3-(1-methyl-1H-pyrazol-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole [ACD/IUPAC Name]
6-(5-Méthyl-1,2-oxazol-3-yl)-3-(1-méthyl-1H-pyrazol-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole [French] [ACD/IUPAC Name]
1436004-20-4 [RN]
5-methyl-3-[3-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-1,2-oxazole
AGN-PC-0JJ9EH
AKOS022123133
MCULE-4769405092
MolPort-027-715-625
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.8±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.910
    Molar Refractivity: 75.1±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.59
    ACD/LogD (pH 5.5): 1.42
    ACD/BCF (pH 5.5): 7.01
    ACD/KOC (pH 5.5): 140.32
    ACD/LogD (pH 7.4): 1.42
    ACD/BCF (pH 7.4): 7.01
    ACD/KOC (pH 7.4): 140.32
    Polar Surface Area: 115 Å2
    Polarizability: 29.8±0.5 10-24cm3
    Surface Tension: 81.2±7.0 dyne/cm
    Molar Volume: 160.1±7.0 cm3

    Click to predict properties on the Chemicalize site


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