ChemSpider 2D Image | 5-{(1S)-2-[(5,6-Diethyl-2,3-dihydro-1H-inden-2-yl)amino]-1-hydroxyethyl}-8-hydroxy-2(1H)-quinolinone | C24H28N2O3

5-{(1S)-2-[(5,6-Diethyl-2,3-dihydro-1H-inden-2-yl)amino]-1-hydroxyethyl}-8-hydroxy-2(1H)-quinolinone

  • Molecular FormulaC24H28N2O3
  • Average mass392.491 Da
  • Monoisotopic mass392.209991 Da
  • ChemSpider ID25065744

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2(1H)-Quinolinone, 5-[(1S)-2-[(5,6-diethyl-2,3-dihydro-1H-inden-2-yl)amino]-1-hydroxyethyl]-8-hydroxy- [ACD/Index Name]
5-{(1S)-2-[(5,6-Diethyl-2,3-dihydro-1H-inden-2-yl)amino]-1-hydroxyethyl}-8-hydroxy-2(1H)-chinolinon [German] [ACD/IUPAC Name]
5-{(1S)-2-[(5,6-Diéthyl-2,3-dihydro-1H-indén-2-yl)amino]-1-hydroxyéthyl}-8-hydroxy-2(1H)-quinoléinone [French] [ACD/IUPAC Name]
5-{(1S)-2-[(5,6-Diethyl-2,3-dihydro-1H-inden-2-yl)amino]-1-hydroxyethyl}-8-hydroxy-2(1H)-quinolinone [ACD/IUPAC Name]
(s)-indacaterol
1235445-80-3 [RN]
5-[(1R)-2-[(5,6-Diethyl-2,3-dihydro-1H-inden-2-yl)amino]-1-hydroxyethyl]-8-hydroxy-2(1H)-quinolinone
Indacaterol [INN] [USAN] [Wiki]
MFCD28988800

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

QAB 149 [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: 660.3±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 102.1±3.0 kJ/mol
    Flash Point: 353.1±31.5 °C
    Index of Refraction: 1.660
    Molar Refractivity: 113.3±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 4
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 3.88
    ACD/LogD (pH 5.5): 0.68
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 2.67
    ACD/LogD (pH 7.4): 2.13
    ACD/BCF (pH 7.4): 10.86
    ACD/KOC (pH 7.4): 73.86
    Polar Surface Area: 82 Å2
    Polarizability: 44.9±0.5 10-24cm3
    Surface Tension: 64.0±5.0 dyne/cm
    Molar Volume: 306.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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