ChemSpider 2D Image | 3-{3-[4-(2,3-Dihydro-1,4-benzodioxin-2-ylcarbonyl)-1-piperazinyl]-3-oxopropyl}-1,2,3-benzotriazin-4(3H)-one | C23H23N5O5

3-{3-[4-(2,3-Dihydro-1,4-benzodioxin-2-ylcarbonyl)-1-piperazinyl]-3-oxopropyl}-1,2,3-benzotriazin-4(3H)-one

  • Molecular FormulaC23H23N5O5
  • Average mass449.459 Da
  • Monoisotopic mass449.169922 Da
  • ChemSpider ID21528456

More details:

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

1,2,3-Benzotriazin-4(3H)-one, 3-[3-[4-[(2,3-dihydro-1,4-benzodioxin-2-yl)carbonyl]-1-piperazinyl]-3-oxopropyl]- [ACD/Index Name]
3-{3-[4-(2,3-Dihydro-1,4-benzodioxin-2-ylcarbonyl)-1-piperazinyl]-3-oxopropyl}-1,2,3-benzotriazin-4(3H)-on [German] [ACD/IUPAC Name]
3-{3-[4-(2,3-Dihydro-1,4-benzodioxin-2-ylcarbonyl)-1-piperazinyl]-3-oxopropyl}-1,2,3-benzotriazin-4(3H)-one [ACD/IUPAC Name]
3-{3-[4-(2,3-Dihydro-1,4-benzodioxin-2-ylcarbonyl)-1-pipérazinyl]-3-oxopropyl}-1,2,3-benzotriazin-4(3H)-one [French] [ACD/IUPAC Name]
3-[3-[4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperazin-1-yl]-3-oxopropyl]-1,2,3-benzotriazin-4-one
3-{3-[4-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazin-1-yl]-3-oxopropyl}-1,2,3-benzotriazin-4(3H)-one
3-{3-[4-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazino]-3-oxopropyl}-1,2,3-benzotriazin-4(3H)-one
3-{3-[4-(2,3-Dihydro-benzo[1,4]dioxine-2-carbonyl)-piperazin-1-yl]-3-oxo-propyl}-3H-benzo[d][1,2,3]triazin-4-one
3-{3-[4-(2H,3H-benzo[e]1,4-dioxin-2-ylcarbonyl)piperazinyl]-3-oxopropyl}benzo[d]1,2,3-triazin-4-one
903188-09-0 [RN]
More...

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 710.1±70.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.3 mmHg at 25°C
    Enthalpy of Vaporization: 103.8±3.0 kJ/mol
    Flash Point: 383.2±35.7 °C
    Index of Refraction: 1.705
    Molar Refractivity: 119.1±0.5 cm3
    #H bond acceptors: 10
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 1
    ACD/LogP: 1.25
    ACD/LogD (pH 5.5): 1.55
    ACD/BCF (pH 5.5): 8.91
    ACD/KOC (pH 5.5): 166.55
    ACD/LogD (pH 7.4): 1.55
    ACD/BCF (pH 7.4): 8.91
    ACD/KOC (pH 7.4): 166.55
    Polar Surface Area: 104 Å2
    Polarizability: 47.2±0.5 10-24cm3
    Surface Tension: 63.6±7.0 dyne/cm
    Molar Volume: 306.5±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement