ChemSpider 2D Image | 3-{[4-METHYL-2-(4-METHYLPIPERIDIN-1-YL)QUINOLIN-6-YL]CARBAMOYL}PROPANOIC ACID | C20H25N3O3

3-{[4-METHYL-2-(4-METHYLPIPERIDIN-1-YL)QUINOLIN-6-YL]CARBAMOYL}PROPANOIC ACID

  • Molecular FormulaC20H25N3O3
  • Average mass355.431 Da
  • Monoisotopic mass355.189606 Da
  • ChemSpider ID21800510

More details:

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

1119452-23-1 [RN]
3-{[4-METHYL-2-(4-METHYLPIPERIDIN-1-YL)QUINOLIN-6-YL]CARBAMOYL}PROPANOIC ACID
4-{[4-Methyl-2-(4-methyl-1-piperidinyl)-6-chinolinyl]amino}-4-oxobutansäure [German] [ACD/IUPAC Name]
4-{[4-Methyl-2-(4-methyl-1-piperidinyl)-6-quinolinyl]amino}-4-oxobutanoic acid [ACD/IUPAC Name]
Acide 4-{[4-méthyl-2-(4-méthyl-1-pipéridinyl)-6-quinoléinyl]amino}-4-oxobutanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 4-[[4-methyl-2-(4-methyl-1-piperidinyl)-6-quinolinyl]amino]-4-oxo- [ACD/Index Name]
4-((4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl)amino)-4-oxobutanoic acid
4-[[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]amino]-4-oxobutanoic acid
4-{[4-Methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]amino}-4-oxobutanoic acid
MFCD12027144 [MDL number]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 661.4±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 102.2±3.0 kJ/mol
    Flash Point: 353.8±31.5 °C
    Index of Refraction: 1.629
    Molar Refractivity: 101.6±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.57
    ACD/LogD (pH 5.5): 1.56
    ACD/BCF (pH 5.5): 3.51
    ACD/KOC (pH 5.5): 28.21
    ACD/LogD (pH 7.4): 0.36
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.79
    Polar Surface Area: 83 Å2
    Polarizability: 40.3±0.5 10-24cm3
    Surface Tension: 58.7±3.0 dyne/cm
    Molar Volume: 286.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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