ChemSpider 2D Image | [1-(3-{[1-(2-Quinolinyl)-3-azetidinyl]oxy}-2-pyrazinyl)-4-piperidinyl]methanol | C22H25N5O2

[1-(3-{[1-(2-Quinolinyl)-3-azetidinyl]oxy}-2-pyrazinyl)-4-piperidinyl]methanol

  • Molecular FormulaC22H25N5O2
  • Average mass391.466 Da
  • Monoisotopic mass391.200836 Da
  • ChemSpider ID28663574

More details:

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

[1-(3-{[1-(2-Chinolinyl)-3-azetidinyl]oxy}-2-pyrazinyl)-4-piperidinyl]methanol [German] [ACD/IUPAC Name]
[1-(3-{[1-(2-Quinoléinyl)-3-azétidinyl]oxy}-2-pyrazinyl)-4-pipéridinyl]méthanol [French] [ACD/IUPAC Name]
[1-(3-{[1-(2-Quinolinyl)-3-azetidinyl]oxy}-2-pyrazinyl)-4-piperidinyl]methanol [ACD/IUPAC Name]
[1-(3-{[1-(Quinolin-2-Yl)azetidin-3-Yl]oxy}pyrazin-2-Yl)piperidin-4-Yl]methanol
4-Piperidinemethanol, 1-[3-[[1-(2-quinolinyl)-3-azetidinyl]oxy]-2-pyrazinyl]- [ACD/Index Name]
35E
US8497265, 217
US8497265, 239

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

Density: 1.3±0.1 g/cm3
Boiling Point: 621.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.8±3.0 kJ/mol
Flash Point: 329.7±31.5 °C
Index of Refraction: 1.663
Molar Refractivity: 111.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.85
ACD/LogD (pH 5.5): 2.91
ACD/BCF (pH 5.5): 88.81
ACD/KOC (pH 5.5): 792.25
ACD/LogD (pH 7.4): 3.04
ACD/BCF (pH 7.4): 119.80
ACD/KOC (pH 7.4): 1068.67
Polar Surface Area: 75 Å2
Polarizability: 44.1±0.5 10-24cm3
Surface Tension: 65.6±3.0 dyne/cm
Molar Volume: 300.3±3.0 cm3

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