ChemSpider 2D Image | 3-[(1r)-1-[5-Fluoranyl-2-(1,2,3-Triazol-2-Yl)phenyl]ethoxy]-5-(3-Methyl-1h-Pyrazol-4-Yl)pyridin-2-Amine | C19H18FN7O

3-[(1r)-1-[5-Fluoranyl-2-(1,2,3-Triazol-2-Yl)phenyl]ethoxy]-5-(3-Methyl-1h-Pyrazol-4-Yl)pyridin-2-Amine

  • Molecular FormulaC19H18FN7O
  • Average mass379.391 Da
  • Monoisotopic mass379.155701 Da
  • ChemSpider ID31133450
  • 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-[5-fluoro-2-(2H-1,2,3-triazol-2-yl)phenyl]ethoxy]-5-(3-methyl-1H-pyrazol-4-yl)- [ACD/Index Name]
3-[(1r)-1-[5-Fluoranyl-2-(1,2,3-Triazol-2-Yl)phenyl]ethoxy]-5-(3-Methyl-1h-Pyrazol-4-Yl)pyridin-2-Amine
3-{(1R)-1-[5-Fluor-2-(2H-1,2,3-triazol-2-yl)phenyl]ethoxy}-5-(3-methyl-1H-pyrazol-4-yl)-2-pyridinamin [German] [ACD/IUPAC Name]
3-{(1R)-1-[5-Fluoro-2-(2H-1,2,3-triazol-2-yl)phenyl]ethoxy}-5-(3-methyl-1H-pyrazol-4-yl)-2-pyridinamine [ACD/IUPAC Name]
3-{(1R)-1-[5-Fluoro-2-(2H-1,2,3-triazol-2-yl)phényl]éthoxy}-5-(3-méthyl-1H-pyrazol-4-yl)-2-pyridinamine [French] [ACD/IUPAC Name]
OFG

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 610.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.6±3.0 kJ/mol
Flash Point: 322.7±34.3 °C
Index of Refraction: 1.702
Molar Refractivity: 101.9±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.46
ACD/LogD (pH 5.5): 1.27
ACD/BCF (pH 5.5): 2.12
ACD/KOC (pH 5.5): 19.62
ACD/LogD (pH 7.4): 2.72
ACD/BCF (pH 7.4): 60.87
ACD/KOC (pH 7.4): 564.80
Polar Surface Area: 108 Å2
Polarizability: 40.4±0.5 10-24cm3
Surface Tension: 54.0±7.0 dyne/cm
Molar Volume: 263.0±7.0 cm3

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