ChemSpider 2D Image | N-(2-Chlorobenzyl)-1-(2-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine | C17H13ClN6

N-(2-Chlorobenzyl)-1-(2-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

  • Molecular FormulaC17H13ClN6
  • Average mass336.778 Da
  • Monoisotopic mass336.089020 Da
  • ChemSpider ID25964582

More details:

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

1H-Pyrazolo[3,4-d]pyrimidin-4-amine, N-[(2-chlorophenyl)methyl]-1-(2-pyridinyl)- [ACD/Index Name]
N-(2-Chlorbenzyl)-1-(2-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amin [German] [ACD/IUPAC Name]
N-(2-Chlorobenzyl)-1-(2-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine [ACD/IUPAC Name]
N-(2-Chlorobenzyl)-1-(2-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine [French] [ACD/IUPAC Name]
N-(2-chlorobenzyl)-1-(pyridin-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
N-[(2-chlorophenyl)methyl]-1-(pyridin-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 500.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.9±3.0 kJ/mol
Flash Point: 256.6±30.1 °C
Index of Refraction: 1.734
Molar Refractivity: 94.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.95
ACD/LogD (pH 5.5): 2.52
ACD/BCF (pH 5.5): 48.74
ACD/KOC (pH 5.5): 561.89
ACD/LogD (pH 7.4): 2.52
ACD/BCF (pH 7.4): 48.82
ACD/KOC (pH 7.4): 562.72
Polar Surface Area: 69 Å2
Polarizability: 37.5±0.5 10-24cm3
Surface Tension: 58.9±7.0 dyne/cm
Molar Volume: 235.8±7.0 cm3

Click to predict properties on the Chemicalize site


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