ChemSpider 2D Image | N-[2-(4-Benzyl-1-piperazinyl)-2-oxoethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzenesulfonamide | C27H29N3O5S

N-[2-(4-Benzyl-1-piperazinyl)-2-oxoethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzenesulfonamide

  • Molecular FormulaC27H29N3O5S
  • Average mass507.601 Da
  • Monoisotopic mass507.182800 Da
  • ChemSpider ID1079920

More details:

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

Benzenesulfonamide, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]- [ACD/Index Name]
N-[2-(4-Benzyl-1-piperazinyl)-2-oxoethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzenesulfonamide [ACD/IUPAC Name]
N-[2-(4-Benzyl-1-pipérazinyl)-2-oxoéthyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzènesulfonamide [French] [ACD/IUPAC Name]
N-[2-(4-Benzyl-1-piperazinyl)-2-oxoethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzolsulfonamid [German] [ACD/IUPAC Name]
N-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzenesulfonamide
695174-05-1 [RN]
N-[2-(4-Benzyl-piperazin-1-yl)-2-oxo-ethyl]-N-(2,3-dihydro-benzo[1,4]dioxin-6-yl)-benzenesulfonamide
N-[2-(4-benzylpiperazino)-2-keto-ethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzenesulfonamide

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 701.7±70.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 102.7±3.0 kJ/mol
    Flash Point: 378.2±35.7 °C
    Index of Refraction: 1.647
    Molar Refractivity: 137.8±0.4 cm3
    #H bond acceptors: 8
    #H bond donors: 0
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 1
    ACD/LogP: 2.02
    ACD/LogD (pH 5.5): 2.30
    ACD/BCF (pH 5.5): 27.32
    ACD/KOC (pH 5.5): 296.32
    ACD/LogD (pH 7.4): 2.64
    ACD/BCF (pH 7.4): 59.54
    ACD/KOC (pH 7.4): 645.85
    Polar Surface Area: 88 Å2
    Polarizability: 54.6±0.5 10-24cm3
    Surface Tension: 59.7±3.0 dyne/cm
    Molar Volume: 379.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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