ChemSpider 2D Image | 3-Bromo-1-(2-methyl-2-propanyl)-N-[2-(3-methyl-2-pyrazinyl)ethyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine | C16H20BrN7

3-Bromo-1-(2-methyl-2-propanyl)-N-[2-(3-methyl-2-pyrazinyl)ethyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine

  • Molecular FormulaC16H20BrN7
  • Average mass390.281 Da
  • Monoisotopic mass389.096344 Da
  • ChemSpider ID76266275

More details:

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

1H-Pyrazolo[3,4-d]pyrimidin-4-amine, 3-bromo-1-(1,1-dimethylethyl)-N-[2-(3-methyl-2-pyrazinyl)ethyl]- [ACD/Index Name]
3-Brom-1-(2-methyl-2-propanyl)-N-[2-(3-methyl-2-pyrazinyl)ethyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amin [German] [ACD/IUPAC Name]
3-Bromo-1-(2-methyl-2-propanyl)-N-[2-(3-methyl-2-pyrazinyl)ethyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine [ACD/IUPAC Name]
3-Bromo-1-(2-méthyl-2-propanyl)-N-[2-(3-méthyl-2-pyrazinyl)éthyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine [French] [ACD/IUPAC 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: 551.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.2±3.0 kJ/mol
Flash Point: 287.6±30.1 °C
Index of Refraction: 1.686
Molar Refractivity: 98.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.60
ACD/LogD (pH 5.5): 3.15
ACD/BCF (pH 5.5): 144.86
ACD/KOC (pH 5.5): 1222.81
ACD/LogD (pH 7.4): 3.15
ACD/BCF (pH 7.4): 146.09
ACD/KOC (pH 7.4): 1233.20
Polar Surface Area: 81 Å2
Polarizability: 39.0±0.5 10-24cm3
Surface Tension: 50.7±7.0 dyne/cm
Molar Volume: 258.1±7.0 cm3

Click to predict properties on the Chemicalize site


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