ChemSpider 2D Image | N-{[5-({1-[(3-Acetylphenyl)amino]-1-oxo-2-butanyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]methyl}-3,4-dichlorobenzamide | C24H25Cl2N5O3S

N-{[5-({1-[(3-Acetylphenyl)amino]-1-oxo-2-butanyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]methyl}-3,4-dichlorobenzamide

  • Molecular FormulaC24H25Cl2N5O3S
  • Average mass534.458 Da
  • Monoisotopic mass533.105530 Da
  • ChemSpider ID17525696

More details:

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

Benzamide, N-[[5-[[1-[[(3-acetylphenyl)amino]carbonyl]propyl]thio]-4-ethyl-4H-1,2,4-triazol-3-yl]methyl]-3,4-dichloro- [ACD/Index Name]
N-{[5-({1-[(3-Acetylphenyl)amino]-1-oxo-2-butanyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]methyl}-3,4-dichlorbenzamid [German] [ACD/IUPAC Name]
N-{[5-({1-[(3-Acetylphenyl)amino]-1-oxo-2-butanyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]methyl}-3,4-dichlorobenzamide [ACD/IUPAC Name]
N-{[5-({1-[(3-Acétylphényl)amino]-1-oxo-2-butanyl}sulfanyl)-4-éthyl-4H-1,2,4-triazol-3-yl]méthyl}-3,4-dichlorobenzamide [French] [ACD/IUPAC Name]
892707-85-6 [RN]
N-[[5-[1-(3-acetylanilino)-1-oxobutan-2-yl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-3,4-dichlorobenzamide
N-{[5-({1-[(3-acetylphenyl)amino]-1-oxobutan-2-yl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]methyl}-3,4-dichlorobenzamide
N-{[5-({1-[(3-acetylphenyl)carbamoyl]propyl}sulfanyl)-4-ethyl-1,2,4-triazol-3-yl]methyl}-3,4-dichlorobenzamide
N-{[5-({1-[(3-acetylphenyl)carbamoyl]propyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]methyl}-3,4-dichlorobenzamide

    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: 1.652
    Molar Refractivity: 140.7±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 2
    ACD/LogP: 5.38
    ACD/LogD (pH 5.5): 4.39
    ACD/BCF (pH 5.5): 1272.69
    ACD/KOC (pH 5.5): 5807.04
    ACD/LogD (pH 7.4): 4.39
    ACD/BCF (pH 7.4): 1272.69
    ACD/KOC (pH 7.4): 5807.03
    Polar Surface Area: 131 Å2
    Polarizability: 55.8±0.5 10-24cm3
    Surface Tension: 51.6±7.0 dyne/cm
    Molar Volume: 384.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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