ChemSpider 2D Image | 1-Methyl-N~4~-[4-(4-methyl-1-piperidinyl)phenyl]-N~6~-[4-(1-pyrrolidinyl)butyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine | C26H38N8

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

  • Molecular FormulaC26H38N8
  • Average mass462.634 Da
  • Monoisotopic mass462.321930 Da
  • ChemSpider ID124358668

More details:

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

1H-Pyrazolo[3,4-d]pyrimidine-4,6-diamine, 1-methyl-N4-[4-(4-methyl-1-piperidinyl)phenyl]-N6-[4-(1-pyrrolidinyl)butyl]- [ACD/Index Name]
1-Methyl-N4-[4-(4-methyl-1-piperidinyl)phenyl]-N6-[4-(1-pyrrolidinyl)butyl]-1H-pyrazolo[3,4-d]pyrimidin-4,6-diamin [German] [ACD/IUPAC Name]
1-Methyl-N4-[4-(4-methyl-1-piperidinyl)phenyl]-N6-[4-(1-pyrrolidinyl)butyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine [ACD/IUPAC Name]
1-Méthyl-N4-[4-(4-méthyl-1-pipéridinyl)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: 1.3±0.1 g/cm3
Boiling Point: 677.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.4±3.0 kJ/mol
Flash Point: 363.4±34.3 °C
Index of Refraction: 1.677
Molar Refractivity: 136.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.50
ACD/LogD (pH 5.5): 0.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.20
ACD/BCF (pH 7.4): 1.03
ACD/KOC (pH 7.4): 5.67
Polar Surface Area: 74 Å2
Polarizability: 54.1±0.5 10-24cm3
Surface Tension: 51.5±7.0 dyne/cm
Molar Volume: 362.3±7.0 cm3

Click to predict properties on the Chemicalize site


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