ChemSpider 2D Image | 1,3-Dimethyl-N-[1-(1-methyl-1H-pyrazol-4-yl)ethyl]-6-(3-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine | C18H20N8

1,3-Dimethyl-N-[1-(1-methyl-1H-pyrazol-4-yl)ethyl]-6-(3-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

  • Molecular FormulaC18H20N8
  • Average mass348.405 Da
  • Monoisotopic mass348.181091 Da
  • ChemSpider ID29439483

More details:






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

1,3-Dimethyl-N-[1-(1-methyl-1H-pyrazol-4-yl)ethyl]-6-(3-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amin [German] [ACD/IUPAC Name]
1,3-Dimethyl-N-[1-(1-methyl-1H-pyrazol-4-yl)ethyl]-6-(3-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine [ACD/IUPAC Name]
1,3-Diméthyl-N-[1-(1-méthyl-1H-pyrazol-4-yl)éthyl]-6-(3-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine [French] [ACD/IUPAC Name]
1H-Pyrazolo[3,4-d]pyrimidin-4-amine, 1,3-dimethyl-N-[1-(1-methyl-1H-pyrazol-4-yl)ethyl]-6-(3-pyridinyl)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 498.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.7±3.0 kJ/mol
Flash Point: 255.3±28.7 °C
Index of Refraction: 1.722
Molar Refractivity: 100.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.40
ACD/LogD (pH 5.5): 1.74
ACD/BCF (pH 5.5): 12.23
ACD/KOC (pH 5.5): 207.03
ACD/LogD (pH 7.4): 1.75
ACD/BCF (pH 7.4): 12.62
ACD/KOC (pH 7.4): 213.68
Polar Surface Area: 86 Å2
Polarizability: 40.0±0.5 10-24cm3
Surface Tension: 53.0±7.0 dyne/cm
Molar Volume: 254.6±7.0 cm3

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