ChemSpider 2D Image | Methyl 3-({(2E)-3-[5-(3,5-dichlorophenyl)-2-furyl]-2-propenoyl}amino)-4-(4-ethyl-1-piperazinyl)benzoate | C27H27Cl2N3O4

Methyl 3-({(2E)-3-[5-(3,5-dichlorophenyl)-2-furyl]-2-propenoyl}amino)-4-(4-ethyl-1-piperazinyl)benzoate

  • Molecular FormulaC27H27Cl2N3O4
  • Average mass528.427 Da
  • Monoisotopic mass527.137878 Da
  • ChemSpider ID12715844

  • Double-bond stereo - Double-bond stereo

More details:

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

3-({(2E)-3-[5-(3,5-Dichlorophényl)-2-furyl]-2-propenoyl}amino)-4-(4-éthyl-1-pipérazinyl)benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-[[(2E)-3-[5-(3,5-dichlorophenyl)-2-furanyl]-1-oxo-2-propen-1-yl]amino]-4-(4-ethyl-1-piperazinyl)-, methyl ester [ACD/Index Name]
Methyl 3-({(2E)-3-[5-(3,5-dichlorophenyl)-2-furyl]-2-propenoyl}amino)-4-(4-ethyl-1-piperazinyl)benzoate [ACD/IUPAC Name]
Methyl 3-({(2E)-3-[5-(3,5-dichlorophenyl)-2-furyl]prop-2-enoyl}amino)-4-(4-ethylpiperazin-1-yl)benzoate
Methyl-3-({(2E)-3-[5-(3,5-dichlorphenyl)-2-furyl]-2-propenoyl}amino)-4-(4-ethyl-1-piperazinyl)benzoat [German] [ACD/IUPAC Name]
(E)-methyl 3-(3-(5-(3,5-dichlorophenyl)furan-2-yl)acrylamido)-4-(4-ethylpiperazin-1-yl)benzoate
3-{3-[5-(3,5-Dichloro-phenyl)-furan-2-yl]-acryloylamino}-4-(4-ethyl-piperazin-1-yl)-benzoic acid methyl ester
765920-45-4 [RN]
benzoic acid, 3-[[(2E)-3-[5-(3,5-dichlorophenyl)-2-furanyl]-1-oxo-2-propenyl]amino]-4-(4-ethyl-1-piperazinyl)-, methyl ester
methyl 3-({(2E)-3-[5-(3,5-dichlorophenyl)furan-2-yl]prop-2-enoyl}amino)-4-(4-ethylpiperazin-1-yl)benzoate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 715.2±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.3 mmHg at 25°C
    Enthalpy of Vaporization: 104.5±3.0 kJ/mol
    Flash Point: 386.4±32.9 °C
    Index of Refraction: 1.629
    Molar Refractivity: 142.9±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 2
    ACD/LogP: 6.73
    ACD/LogD (pH 5.5): 3.53
    ACD/BCF (pH 5.5): 93.65
    ACD/KOC (pH 5.5): 240.72
    ACD/LogD (pH 7.4): 5.16
    ACD/BCF (pH 7.4): 4024.49
    ACD/KOC (pH 7.4): 10344.93
    Polar Surface Area: 75 Å2
    Polarizability: 56.7±0.5 10-24cm3
    Surface Tension: 53.2±3.0 dyne/cm
    Molar Volume: 402.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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