ChemSpider 2D Image | N-[(2-Amino-3-pyridinyl)methyl]-3-bromo-1-(2-methyl-2-propanyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine | C15H18BrN7

N-[(2-Amino-3-pyridinyl)methyl]-3-bromo-1-(2-methyl-2-propanyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

  • Molecular FormulaC15H18BrN7
  • Average mass376.254 Da
  • Monoisotopic mass375.080688 Da
  • ChemSpider ID76266358

More details:

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

1H-Pyrazolo[3,4-d]pyrimidin-4-amine, N-[(2-amino-3-pyridinyl)methyl]-3-bromo-1-(1,1-dimethylethyl)- [ACD/Index Name]
N-[(2-Amino-3-pyridinyl)methyl]-3-brom-1-(2-methyl-2-propanyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amin [German] [ACD/IUPAC Name]
N-[(2-Amino-3-pyridinyl)methyl]-3-bromo-1-(2-methyl-2-propanyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine [ACD/IUPAC Name]
N-[(2-Amino-3-pyridinyl)méthyl]-3-bromo-1-(2-méthyl-2-propanyl)-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: 1.6±0.1 g/cm3
Boiling Point: 562.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.5±3.0 kJ/mol
Flash Point: 293.7±28.7 °C
Index of Refraction: 1.719
Molar Refractivity: 92.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.48
ACD/LogD (pH 5.5): 1.90
ACD/BCF (pH 5.5): 9.99
ACD/KOC (pH 5.5): 101.57
ACD/LogD (pH 7.4): 2.74
ACD/BCF (pH 7.4): 70.04
ACD/KOC (pH 7.4): 711.99
Polar Surface Area: 95 Å2
Polarizability: 36.8±0.5 10-24cm3
Surface Tension: 56.8±7.0 dyne/cm
Molar Volume: 235.0±7.0 cm3

Click to predict properties on the Chemicalize site


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