ChemSpider 2D Image | Ethyl 4-(4-acetyl-1-piperazinyl)-3-{[3-nitro-4-(1-pyrrolidinyl)benzoyl]amino}benzoate | C26H31N5O6

Ethyl 4-(4-acetyl-1-piperazinyl)-3-{[3-nitro-4-(1-pyrrolidinyl)benzoyl]amino}benzoate

  • Molecular FormulaC26H31N5O6
  • Average mass509.554 Da
  • Monoisotopic mass509.227448 Da
  • ChemSpider ID12812128

More details:

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

4-(4-Acétyl-1-pipérazinyl)-3-{[3-nitro-4-(1-pyrrolidinyl)benzoyl]amino}benzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-(4-acetyl-1-piperazinyl)-3-[[3-nitro-4-(1-pyrrolidinyl)benzoyl]amino]-, ethyl ester [ACD/Index Name]
Ethyl 4-(4-acetyl-1-piperazinyl)-3-{[3-nitro-4-(1-pyrrolidinyl)benzoyl]amino}benzoate [ACD/IUPAC Name]
Ethyl 4-(4-acetylpiperazin-1-yl)-3-{[3-nitro-4-(pyrrolidin-1-yl)benzoyl]amino}benzoate
Ethyl-4-(4-acetyl-1-piperazinyl)-3-{[3-nitro-4-(1-pyrrolidinyl)benzoyl]amino}benzoat [German] [ACD/IUPAC Name]
4-(4-Acetyl-piperazin-1-yl)-3-(3-nitro-4-pyrrolidin-1-yl-benzoylamino)-benzoic acid ethyl ester
767315-00-4 [RN]
ethyl 4-(4-acetylpiperazin-1-yl)-3-({[3-nitro-4-(pyrrolidin-1-yl)phenyl]carbonyl}amino)benzoate
ethyl 4-(4-acetylpiperazin-1-yl)-3-(3-nitro-4-(pyrrolidin-1-yl)benzamido)benzoate
ethyl 4-(4-acetylpiperazin-1-yl)-3-[(3-nitro-4-pyrrolidin-1-ylbenzoyl)amino]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: 685.8±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 100.6±3.0 kJ/mol
    Flash Point: 368.6±31.5 °C
    Index of Refraction: 1.633
    Molar Refractivity: 137.0±0.3 cm3
    #H bond acceptors: 11
    #H bond donors: 1
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 2
    ACD/LogP: 3.50
    ACD/LogD (pH 5.5): 3.24
    ACD/BCF (pH 5.5): 171.38
    ACD/KOC (pH 5.5): 1382.49
    ACD/LogD (pH 7.4): 3.24
    ACD/BCF (pH 7.4): 171.40
    ACD/KOC (pH 7.4): 1382.62
    Polar Surface Area: 128 Å2
    Polarizability: 54.3±0.5 10-24cm3
    Surface Tension: 61.5±3.0 dyne/cm
    Molar Volume: 383.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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