Found 238 results

Search term: MF = 'C_{27}H_{30}N_{2}O_{4}S_{2}'
ChemSpider 2D Image | Butyl 4-({4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoate | C27H30N2O4S2

Butyl 4-({4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoate

  • Molecular FormulaC27H30N2O4S2
  • Average mass510.668 Da
  • Monoisotopic mass510.164703 Da
  • ChemSpider ID4707731

  • Double-bond stereo - Double-bond stereo

More details:

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

4-({4-[(5Z)-5-(4-Éthylbenzylidène)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoate de butyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[[4-[(5Z)-5-[(4-ethylphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-1-oxobutyl]amino]-, butyl ester [ACD/Index Name]
Butyl 4-({4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoate [ACD/IUPAC Name]
Butyl-4-({4-[(5Z)-5-(4-ethylbenzyliden)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoat [German] [ACD/IUPAC Name]
372975-23-0 [RN]
butyl 4-(4-{5-[(4-ethylphenyl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoylamino)benzoate
butyl 4-[4-[(5Z)-5-[(4-ethylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoate

    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: 1.641
    Molar Refractivity: 143.3±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 12
    #Rule of 5 Violations: 2
    ACD/LogP: 6.55
    ACD/LogD (pH 5.5): 5.03
    ACD/BCF (pH 5.5): 3936.46
    ACD/KOC (pH 5.5): 13030.79
    ACD/LogD (pH 7.4): 5.03
    ACD/BCF (pH 7.4): 3936.46
    ACD/KOC (pH 7.4): 13030.79
    Polar Surface Area: 133 Å2
    Polarizability: 56.8±0.5 10-24cm3
    Surface Tension: 63.0±5.0 dyne/cm
    Molar Volume: 397.1±5.0 cm3

    Click to predict properties on the Chemicalize site


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