Found 196 results

Search term: MF = 'C_{21}H_{21}ClN_{4}S'
ChemSpider 2D Image | 3-(3-Chlorophenyl)-6-[1-(4-isobutylphenyl)ethyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole | C21H21ClN4S

3-(3-Chlorophenyl)-6-[1-(4-isobutylphenyl)ethyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

  • Molecular FormulaC21H21ClN4S
  • Average mass396.936 Da
  • Monoisotopic mass396.117554 Da
  • ChemSpider ID21629687

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-(3-chlorophenyl)-6-[1-[4-(2-methylpropyl)phenyl]ethyl]- [ACD/Index Name]
3-(3-Chlorophenyl)-6-[1-(4-isobutylphenyl)ethyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole [ACD/IUPAC Name]
3-(3-Chlorophényl)-6-[1-(4-isobutylphényl)éthyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole [French] [ACD/IUPAC Name]
3-(3-Chlorphenyl)-6-[1-(4-isobutylphenyl)ethyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol [German] [ACD/IUPAC Name]
3-(3-chlorophenyl)-6-[1-[4-(2-methylpropyl)phenyl]ethyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(3-chlorophenyl)-6-{1-[4-(2-methylpropyl)phenyl]ethyl}[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(3-chlorophenyl)-6-{1-[4-(2-methylpropyl)phenyl]ethyl}-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
929869-21-6 [RN]

    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: 1.678
    Molar Refractivity: 114.1±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 1
    ACD/LogP: 7.50
    ACD/LogD (pH 5.5): 6.26
    ACD/BCF (pH 5.5): 33612.68
    ACD/KOC (pH 5.5): 60486.00
    ACD/LogD (pH 7.4): 6.26
    ACD/BCF (pH 7.4): 33612.68
    ACD/KOC (pH 7.4): 60486.00
    Polar Surface Area: 71 Å2
    Polarizability: 45.2±0.5 10-24cm3
    Surface Tension: 47.7±7.0 dyne/cm
    Molar Volume: 302.6±7.0 cm3

    Click to predict properties on the Chemicalize site


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