ChemSpider 2D Image | 2-(2-{4-[2-Hydroxy-3-(2-naphthyloxy)propyl]-1-piperazinyl}ethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione | C31H31N3O4

2-(2-{4-[2-Hydroxy-3-(2-naphthyloxy)propyl]-1-piperazinyl}ethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione

  • Molecular FormulaC31H31N3O4
  • Average mass509.595 Da
  • Monoisotopic mass509.231445 Da
  • ChemSpider ID3314876

More details:

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

1H-Benz[de]isoquinoline-1,3(2H)-dione, 2-[2-[4-[2-hydroxy-3-(2-naphthalenyloxy)propyl]-1-piperazinyl]ethyl]- [ACD/Index Name]
2-(2-{4-[2-Hydroxy-3-(2-naphthyloxy)propyl]-1-piperazinyl}ethyl)-1H-benzo[de]isochinolin-1,3(2H)-dion [German] [ACD/IUPAC Name]
2-(2-{4-[2-Hydroxy-3-(2-naphthyloxy)propyl]-1-piperazinyl}ethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione [ACD/IUPAC Name]
2-(2-{4-[2-Hydroxy-3-(2-naphtyloxy)propyl]-1-pipérazinyl}éthyl)-1H-benzo[de]isoquinoléine-1,3(2H)-dione [French] [ACD/IUPAC Name]
2-(2-(4-(2-hydroxy-3-(naphthalen-2-yloxy)propyl)piperazin-1-yl)ethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
2-[2-[4-(2-hydroxy-3-naphthalen-2-yloxypropyl)piperazin-1-yl]ethyl]benzo[de]isoquinoline-1,3-dione
2-[2-[4-[2-hydroxy-3-(2-naphthoxy)propyl]piperazino]ethyl]benzo[de]isoquinoline-1,3-quinone
3-(2-{4-[2-hydroxy-3-(naphthalen-2-yloxy)propyl]piperazin-1-yl}ethyl)-3-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-2,4-dione
610757-01-2 [RN]

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

MLS000723312 [DBID]
SMR000236439 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 731.6±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.5 mmHg at 25°C
    Enthalpy of Vaporization: 112.1±3.0 kJ/mol
    Flash Point: 396.2±32.9 °C
    Index of Refraction: 1.676
    Molar Refractivity: 147.9±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 1
    ACD/LogP: 3.66
    ACD/LogD (pH 5.5): 2.45
    ACD/BCF (pH 5.5): 19.01
    ACD/KOC (pH 5.5): 109.67
    ACD/LogD (pH 7.4): 3.78
    ACD/BCF (pH 7.4): 408.96
    ACD/KOC (pH 7.4): 2358.84
    Polar Surface Area: 73 Å2
    Polarizability: 58.7±0.5 10-24cm3
    Surface Tension: 59.4±3.0 dyne/cm
    Molar Volume: 393.3±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement