ChemSpider 2D Image | 1,3-Dimethyl-N-[1-(3-methyl-1H-1,2,4-triazol-5-yl)ethyl]-6-(4-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine | C17H19N9

1,3-Dimethyl-N-[1-(3-methyl-1H-1,2,4-triazol-5-yl)ethyl]-6-(4-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

  • Molecular FormulaC17H19N9
  • Average mass349.393 Da
  • Monoisotopic mass349.176331 Da
  • ChemSpider ID29470091

More details:

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

1,3-Dimethyl-N-[1-(3-methyl-1H-1,2,4-triazol-5-yl)ethyl]-6-(4-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amin [German] [ACD/IUPAC Name]
1,3-Dimethyl-N-[1-(3-methyl-1H-1,2,4-triazol-5-yl)ethyl]-6-(4-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine [ACD/IUPAC Name]
1,3-Diméthyl-N-[1-(3-méthyl-1H-1,2,4-triazol-5-yl)éthyl]-6-(4-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-(5-methyl-1H-1,2,4-triazol-3-yl)ethyl]-6-(4-pyridinyl)- [ACD/Index 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: 582.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.1±3.0 kJ/mol
Flash Point: 306.2±32.9 °C
Index of Refraction: 1.768
Molar Refractivity: 98.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.26
ACD/LogD (pH 5.5): 1.10
ACD/BCF (pH 5.5): 4.00
ACD/KOC (pH 5.5): 93.56
ACD/LogD (pH 7.4): 1.10
ACD/BCF (pH 7.4): 4.03
ACD/KOC (pH 7.4): 94.34
Polar Surface Area: 110 Å2
Polarizability: 39.0±0.5 10-24cm3
Surface Tension: 57.7±7.0 dyne/cm
Molar Volume: 237.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement