ChemSpider 2D Image | 1-{5-[(6,7-Dimethoxy-4-quinolinyl)oxy]-2-pyridinyl}-3-[(1R,2S)-2-phenylcyclopropyl]urea | C26H24N4O4

1-{5-[(6,7-Dimethoxy-4-quinolinyl)oxy]-2-pyridinyl}-3-[(1R,2S)-2-phenylcyclopropyl]urea

  • Molecular FormulaC26H24N4O4
  • Average mass456.493 Da
  • Monoisotopic mass456.179749 Da
  • ChemSpider ID34949445

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-{5-[(6,7-Dimethoxy-4-chinolinyl)oxy]-2-pyridinyl}-3-[(1R,2S)-2-phenylcyclopropyl]harnstoff [German] [ACD/IUPAC Name]
1-{5-[(6,7-Diméthoxy-4-quinoléinyl)oxy]-2-pyridinyl}-3-[(1R,2S)-2-phénylcyclopropyl]urée [French] [ACD/IUPAC Name]
1-{5-[(6,7-Dimethoxy-4-quinolinyl)oxy]-2-pyridinyl}-3-[(1R,2S)-2-phenylcyclopropyl]urea [ACD/IUPAC Name]
1-{5-[(6,7-Dimethoxyquinolin-4-Yl)oxy]pyridin-2-Yl}-3-[(1r,2s)-2-Phenylcyclopropyl]urea
Urea, N-[5-[(6,7-dimethoxy-4-quinolinyl)oxy]-2-pyridinyl]-N'-[(1R,2S)-2-phenylcyclopropyl]- [ACD/Index Name]
Dimethoxyquinoline, 1
FPU

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

Density: 1.4±0.1 g/cm3
Boiling Point: 635.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.9±3.0 kJ/mol
Flash Point: 338.0±31.5 °C
Index of Refraction: 1.681
Molar Refractivity: 127.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.56
ACD/LogD (pH 5.5): 3.73
ACD/BCF (pH 5.5): 381.98
ACD/KOC (pH 5.5): 2290.23
ACD/LogD (pH 7.4): 3.84
ACD/BCF (pH 7.4): 485.20
ACD/KOC (pH 7.4): 2909.11
Polar Surface Area: 95 Å2
Polarizability: 50.6±0.5 10-24cm3
Surface Tension: 68.7±5.0 dyne/cm
Molar Volume: 337.5±5.0 cm3

Click to predict properties on the Chemicalize site


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