ChemSpider 2D Image | 3-{[2-(3,5-dimethylpiperidin-1-yl)-4-methylquinolin-6-yl]carbamoyl}propanoic acid | C21H27N3O3

3-{[2-(3,5-dimethylpiperidin-1-yl)-4-methylquinolin-6-yl]carbamoyl}propanoic acid

  • Molecular FormulaC21H27N3O3
  • Average mass369.457 Da
  • Monoisotopic mass369.205231 Da
  • ChemSpider ID21800508

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

3-{[2-(3,5-dimethylpiperidin-1-yl)-4-methylquinolin-6-yl]carbamoyl}propanoic acid
4-((2-(3,5-dimethylpiperidin-1-yl)-4-methylquinolin-6-yl)amino)-4-oxobutanoic acid
4-{[2-(3,5-Dimethyl-1-piperidinyl)-4-methyl-6-chinolinyl]amino}-4-oxobutansäure [German] [ACD/IUPAC Name]
4-{[2-(3,5-Dimethyl-1-piperidinyl)-4-methyl-6-quinolinyl]amino}-4-oxobutanoic acid [ACD/IUPAC Name]
4-{[2-(3,5-dimethylpiperidin-1-yl)-4-methylquinolin-6-yl]amino}-4-oxobutanoic acid
685524-64-5 [RN]
Acide 4-{[2-(3,5-diméthyl-1-pipéridinyl)-4-méthyl-6-quinoléinyl]amino}-4-oxobutanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 4-[[2-(3,5-dimethyl-1-piperidinyl)-4-methyl-6-quinolinyl]amino]-4-oxo- [ACD/Index Name]
4-([2-(3,5-Dimethylpiperidin-1-yl)-4-methylquinolin-6-yl]amino)-4-oxobutanoic acid
4-[[2-(3,5-dimethylpiperidin-1-yl)-4-methylquinolin-6-yl]amino]-4-oxobutanoic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

MFCD12027141 [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 657.7±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 101.7±3.0 kJ/mol
    Flash Point: 351.5±31.5 °C
    Index of Refraction: 1.612
    Molar Refractivity: 106.3±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 4.06
    ACD/LogD (pH 5.5): 2.03
    ACD/BCF (pH 5.5): 8.05
    ACD/KOC (pH 5.5): 51.05
    ACD/LogD (pH 7.4): 0.83
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.25
    Polar Surface Area: 83 Å2
    Polarizability: 42.2±0.5 10-24cm3
    Surface Tension: 54.0±3.0 dyne/cm
    Molar Volume: 306.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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