ChemSpider 2D Image | 4-{(E)-[({[5-(4-Chlorophenyl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazono]methyl}-2-methoxyphenyl acetate | C26H28ClN5O4S

4-{(E)-[({[5-(4-Chlorophenyl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazono]methyl}-2-methoxyphenyl acetate

  • Molecular FormulaC26H28ClN5O4S
  • Average mass542.050 Da
  • Monoisotopic mass541.155029 Da
  • ChemSpider ID7908192

  • Double-bond stereo - Double-bond stereo

More details:

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

4-{(E)-[({[5-(4-Chlorophenyl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazono]methyl}-2-methoxyphenyl acetate [ACD/IUPAC Name]
4-{(E)-[({[5-(4-Chlorphenyl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazono]methyl}-2-methoxyphenyl-acetat [German] [ACD/IUPAC Name]
Acétate de 4-{(E)-[(2-{[5-(4-chlorophényl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}acétyl)hydrazono]méthyl}-2-méthoxyphényle [French] [ACD/IUPAC Name]
Acetic acid, 2-[[5-(4-chlorophenyl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(1E)-[4-(acetyloxy)-3-methoxyphenyl]methylene]hydrazide [ACD/Index Name]
[4-[(E)-[[2-[[5-(4-chlorophenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] acetate
4-((1E)-2-{2-[5-(4-chlorophenyl)-4-cyclohexyl(1,2,4-triazol-3-ylthio)]acetylamino}-2-azavinyl)-2-methoxyphenyl acetate
4-{(E)-[2-({[5-(4-chlorophenyl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-methoxyphenyl acetate
487025-14-9 [RN]
Acetic acid 4-({2-[5-(4-chloro-phenyl)-4-cyclohexyl-4H-[1,2,4]triazol-3-ylsulfanyl]-acetyl}-hydrazonomethyl)-2-methoxy-phenyl ester

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

    Density: 1.4±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.653
    Molar Refractivity: 144.9±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 1
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 2
    ACD/LogP: 7.13
    ACD/LogD (pH 5.5): 5.38
    ACD/BCF (pH 5.5): 7175.41
    ACD/KOC (pH 5.5): 20026.46
    ACD/LogD (pH 7.4): 5.38
    ACD/BCF (pH 7.4): 7174.33
    ACD/KOC (pH 7.4): 20023.43
    Polar Surface Area: 133 Å2
    Polarizability: 57.4±0.5 10-24cm3
    Surface Tension: 52.5±7.0 dyne/cm
    Molar Volume: 395.7±7.0 cm3

    Click to predict properties on the Chemicalize site


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