ChemSpider 2D Image | 1-Methyl-N~4~-[2-(2-methyl-2-propanyl)phenyl]-N~6~-[4-(1-pyrrolidinyl)butyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine | C24H35N7

1-Methyl-N4-[2-(2-methyl-2-propanyl)phenyl]-N6-[4-(1-pyrrolidinyl)butyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine

  • Molecular FormulaC24H35N7
  • Average mass421.582 Da
  • Monoisotopic mass421.295380 Da
  • ChemSpider ID124361797

More details:

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

1H-Pyrazolo[3,4-d]pyrimidine-4,6-diamine, N4-[2-(1,1-dimethylethyl)phenyl]-1-methyl-N6-[4-(1-pyrrolidinyl)butyl]- [ACD/Index Name]
1-Methyl-N4-[2-(2-methyl-2-propanyl)phenyl]-N6-[4-(1-pyrrolidinyl)butyl]-1H-pyrazolo[3,4-d]pyrimidin-4,6-diamin [German] [ACD/IUPAC Name]
1-Methyl-N4-[2-(2-methyl-2-propanyl)phenyl]-N6-[4-(1-pyrrolidinyl)butyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine [ACD/IUPAC Name]
1-Méthyl-N4-[2-(2-méthyl-2-propanyl)phényl]-N6-[4-(1-pyrrolidinyl)butyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 596.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.8±3.0 kJ/mol
Flash Point: 314.3±32.9 °C
Index of Refraction: 1.635
Molar Refractivity: 125.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.94
ACD/LogD (pH 5.5): 1.53
ACD/BCF (pH 5.5): 1.51
ACD/KOC (pH 5.5): 6.01
ACD/LogD (pH 7.4): 1.88
ACD/BCF (pH 7.4): 3.36
ACD/KOC (pH 7.4): 13.38
Polar Surface Area: 71 Å2
Polarizability: 49.9±0.5 10-24cm3
Surface Tension: 45.6±7.0 dyne/cm
Molar Volume: 351.6±7.0 cm3

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