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

N4-(4-Isopropyl-3-methylphenyl)-1-methyl-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 ID124361563

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-[3-methyl-4-(1-methylethyl)phenyl]-N6-[4-(1-pyrrolidinyl)butyl]- [ACD/Index Name]
N4-(4-Isopropyl-3-methylphenyl)-1-methyl-N6-[4-(1-pyrrolidinyl)butyl]-1H-pyrazolo[3,4-d]pyrimidin-4,6-diamin [German] [ACD/IUPAC Name]
N4-(4-Isopropyl-3-methylphenyl)-1-methyl-N6-[4-(1-pyrrolidinyl)butyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine [ACD/IUPAC Name]
N4-(4-Isopropyl-3-méthylphényl)-1-méthyl-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: 606.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.2±3.0 kJ/mol
Flash Point: 320.8±34.3 °C
Index of Refraction: 1.644
Molar Refractivity: 125.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.05
ACD/LogD (pH 5.5): 1.51
ACD/BCF (pH 5.5): 1.46
ACD/KOC (pH 5.5): 5.80
ACD/LogD (pH 7.4): 1.87
ACD/BCF (pH 7.4): 3.34
ACD/KOC (pH 7.4): 13.31
Polar Surface Area: 71 Å2
Polarizability: 49.7±0.5 10-24cm3
Surface Tension: 45.4±7.0 dyne/cm
Molar Volume: 346.3±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement