Found 186 results

Search term: MF = 'C_{32}H_{30}N_{2}O_{4}S'
ChemSpider 2D Image | 13-[5-(1,3-Benzothiazol-2-yl)-2-furyl]-9,10-dimethoxy-3,3-dimethyl-2,3,4,6,7,13-hexahydro-1H-isoquino[2,1-a]quinolin-1-one | C32H30N2O4S

13-[5-(1,3-Benzothiazol-2-yl)-2-furyl]-9,10-dimethoxy-3,3-dimethyl-2,3,4,6,7,13-hexahydro-1H-isoquino[2,1-a]quinolin-1-one

  • Molecular FormulaC32H30N2O4S
  • Average mass538.657 Da
  • Monoisotopic mass538.192627 Da
  • ChemSpider ID21527692

More details:

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

13-[5-(1,3-Benzothiazol-2-yl)-2-furyl]-9,10-dimethoxy-3,3-dimethyl-2,3,4,6,7,13-hexahydro-1H-isochinolino[2,1-a]chinolin-1-on [German] [ACD/IUPAC Name]
13-[5-(1,3-Benzothiazol-2-yl)-2-furyl]-9,10-dimethoxy-3,3-dimethyl-2,3,4,6,7,13-hexahydro-1H-isoquino[2,1-a]quinolin-1-one
13-[5-(1,3-Benzothiazol-2-yl)-2-furyl]-9,10-diméthoxy-3,3-diméthyl-2,3,4,6,7,13-hexahydro-1H-isoquinoléino[2,1-a]quinoléin-1-one [French] [ACD/IUPAC Name]
13-[5-(1,3-Benzothiazol-2-yl)-2-furyl]-9,10-dimethoxy-3,3-dimethyl-2,3,4,6,7,13-hexahydro-1H-isoquinolino[2,1-a]quinolin-1-one [ACD/IUPAC Name]
1H-Dibenzo[a,f]quinolizin-1-one, 13-[5-(2-benzothiazolyl)-2-furanyl]-2,3,4,6,7,13-hexahydro-9,10-dimethoxy-3,3-dimethyl- [ACD/Index Name]
13-[5-(1,3-benzothiazol-2-yl)furan-2-yl]-9,10-dimethoxy-3,3-dimethyl-2,3,4,6,7,13-hexahydro-1H-isoquino[2,1-a]quinolin-1-one
13-[5-(1,3-benzothiazol-2-yl)furan-2-yl]-9,10-dimethoxy-3,3-dimethyl-4,6,7,13-tetrahydro-2H-isoquinolino[2,1-a]quinolin-1-one
898918-06-4 [RN]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 733.1±70.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.4 mmHg at 25°C
    Enthalpy of Vaporization: 107.0±3.0 kJ/mol
    Flash Point: 397.2±35.7 °C
    Index of Refraction: 1.695
    Molar Refractivity: 152.1±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 2
    ACD/LogP: 5.75
    ACD/LogD (pH 5.5): 5.86
    ACD/BCF (pH 5.5): 16632.27
    ACD/KOC (pH 5.5): 36531.93
    ACD/LogD (pH 7.4): 5.86
    ACD/BCF (pH 7.4): 16668.45
    ACD/KOC (pH 7.4): 36611.39
    Polar Surface Area: 93 Å2
    Polarizability: 60.3±0.5 10-24cm3
    Surface Tension: 66.0±5.0 dyne/cm
    Molar Volume: 395.6±5.0 cm3

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