ChemSpider 2D Image | 3-[(1R)-1-(2,6-Dichloro-3-fluorophenyl)ethoxy]-6-[1-(4-piperidinyl)-1H-pyrazol-4-yl]-2-pyridinamine | C21H22Cl2FN5O

3-[(1R)-1-(2,6-Dichloro-3-fluorophenyl)ethoxy]-6-[1-(4-piperidinyl)-1H-pyrazol-4-yl]-2-pyridinamine

  • Molecular FormulaC21H22Cl2FN5O
  • Average mass450.337 Da
  • Monoisotopic mass449.118530 Da
  • ChemSpider ID48057500

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-Pyridinamine, 3-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-[1-(4-piperidinyl)-1H-pyrazol-4-yl]- [ACD/Index Name]
3-[(1R)-1-(2,6-Dichlor-3-fluorphenyl)ethoxy]-6-[1-(4-piperidinyl)-1H-pyrazol-4-yl]-2-pyridinamin [German] [ACD/IUPAC Name]
3-[(1R)-1-(2,6-Dichloro-3-fluorophenyl)ethoxy]-6-[1-(4-piperidinyl)-1H-pyrazol-4-yl]-2-pyridinamine [ACD/IUPAC Name]
3-[(1R)-1-(2,6-Dichloro-3-fluorophényl)éthoxy]-6-[1-(4-pipéridinyl)-1H-pyrazol-4-yl]-2-pyridinamine [French] [ACD/IUPAC Name]
1395950-48-7 [RN]
15889-93-7 [RN]
1795786-86-5 [RN]
3-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(1-piperidin-4-ylpyrazol-4-yl)pyridin-2-amine
3-[(1R)-1-(2,6-Dichloro-3-fluorophenyl)ethoxy]-6-[1-(piperidin-4-yl)-1H-pyrazol-4-yl]pyridin-2-amine
Crizotinib-d5

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 619.7±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 91.9±3.0 kJ/mol
    Flash Point: 328.6±31.5 °C
    Index of Refraction: 1.673
    Molar Refractivity: 114.4±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 3
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 4.40
    ACD/LogD (pH 5.5): 1.18
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 3.16
    ACD/LogD (pH 7.4): 2.17
    ACD/BCF (pH 7.4): 7.29
    ACD/KOC (pH 7.4): 31.39
    Polar Surface Area: 78 Å2
    Polarizability: 45.4±0.5 10-24cm3
    Surface Tension: 51.1±7.0 dyne/cm
    Molar Volume: 305.2±7.0 cm3

    Click to predict properties on the Chemicalize site


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