ChemSpider 2D Image | 3-Bromo-1-(2-methyl-2-propanyl)-4-(7-methyl-2,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidine | C16H20BrN7

3-Bromo-1-(2-methyl-2-propanyl)-4-(7-methyl-2,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidine

  • Molecular FormulaC16H20BrN7
  • Average mass390.281 Da
  • Monoisotopic mass389.096344 Da
  • ChemSpider ID76267210

More details:

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

1H-Pyrazolo[3,4-d]pyrimidine, 3-bromo-1-(1,1-dimethylethyl)-4-(2,4,6,7-tetrahydro-7-methyl-5H-pyrazolo[4,3-c]pyridin-5-yl)- [ACD/Index Name]
3-Brom-1-(2-methyl-2-propanyl)-4-(7-methyl-2,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidin [German] [ACD/IUPAC Name]
3-Bromo-1-(2-methyl-2-propanyl)-4-(7-methyl-2,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidine [ACD/IUPAC Name]
3-Bromo-1-(2-méthyl-2-propanyl)-4-(7-méthyl-2,4,6,7-tétrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidine [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 582.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.0±3.0 kJ/mol
Flash Point: 305.8±30.1 °C
Index of Refraction: 1.756
Molar Refractivity: 96.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.57
ACD/LogD (pH 5.5): 2.92
ACD/BCF (pH 5.5): 96.85
ACD/KOC (pH 5.5): 913.88
ACD/LogD (pH 7.4): 2.93
ACD/BCF (pH 7.4): 98.71
ACD/KOC (pH 7.4): 931.42
Polar Surface Area: 76 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 57.3±7.0 dyne/cm
Molar Volume: 235.7±7.0 cm3

Click to predict properties on the Chemicalize site


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