ChemSpider 2D Image | 2-(5-Bromo-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)ethyl 1-propionyl-3-piperidinecarboxylate | C18H23BrN4O3

2-(5-Bromo-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)ethyl 1-propionyl-3-piperidinecarboxylate

  • Molecular FormulaC18H23BrN4O3
  • Average mass423.304 Da
  • Monoisotopic mass422.095337 Da
  • ChemSpider ID30289740

More details:

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

1-Propionyl-3-pipéridinecarboxylate de 2-(5-bromo-3-méthyl-1H-pyrazolo[3,4-b]pyridin-1-yl)éthyle [French] [ACD/IUPAC Name]
2-(5-Brom-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)ethyl-1-propionyl-3-piperidincarboxylat [German] [ACD/IUPAC Name]
2-(5-Bromo-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)ethyl 1-propionyl-3-piperidinecarboxylate [ACD/IUPAC Name]
3-Piperidinecarboxylic acid, 1-(1-oxopropyl)-, 2-(5-bromo-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)ethyl ester [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 573.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.0±3.0 kJ/mol
Flash Point: 300.8±30.1 °C
Index of Refraction: 1.651
Molar Refractivity: 102.2±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.66
ACD/LogD (pH 5.5): 2.69
ACD/BCF (pH 5.5): 65.24
ACD/KOC (pH 5.5): 692.54
ACD/LogD (pH 7.4): 2.69
ACD/BCF (pH 7.4): 65.25
ACD/KOC (pH 7.4): 692.60
Polar Surface Area: 77 Å2
Polarizability: 40.5±0.5 10-24cm3
Surface Tension: 52.2±7.0 dyne/cm
Molar Volume: 279.6±7.0 cm3

Click to predict properties on the Chemicalize site


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