ChemSpider 2D Image | 1,3-Dimethyl-N-[(4-methyl-1H-benzimidazol-2-yl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine | C16H17N7

1,3-Dimethyl-N-[(4-methyl-1H-benzimidazol-2-yl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine

  • Molecular FormulaC16H17N7
  • Average mass307.353 Da
  • Monoisotopic mass307.154541 Da
  • ChemSpider ID29457471

More details:

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

1,3-Dimethyl-N-[(4-methyl-1H-benzimidazol-2-yl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amin [German] [ACD/IUPAC Name]
1,3-Dimethyl-N-[(4-methyl-1H-benzimidazol-2-yl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine [ACD/IUPAC Name]
1,3-Diméthyl-N-[(4-méthyl-1H-benzimidazol-2-yl)méthyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine [French] [ACD/IUPAC Name]
1H-Pyrazolo[3,4-d]pyrimidin-4-amine, 1,3-dimethyl-N-[(4-methyl-1H-benzimidazol-2-yl)methyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 639.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.4±3.0 kJ/mol
Flash Point: 340.5±31.5 °C
Index of Refraction: 1.764
Molar Refractivity: 87.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.15
ACD/LogD (pH 5.5): 1.84
ACD/BCF (pH 5.5): 11.65
ACD/KOC (pH 5.5): 152.35
ACD/LogD (pH 7.4): 2.26
ACD/BCF (pH 7.4): 30.72
ACD/KOC (pH 7.4): 401.58
Polar Surface Area: 84 Å2
Polarizability: 34.8±0.5 10-24cm3
Surface Tension: 56.6±7.0 dyne/cm
Molar Volume: 212.6±7.0 cm3

Click to predict properties on the Chemicalize site


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