ChemSpider 2D Image | N-[1-Methyl-6-(4-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N'-(3-pyridinyl)-1,3-propanediamine | C19H20N8

N-[1-Methyl-6-(4-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N'-(3-pyridinyl)-1,3-propanediamine

  • Molecular FormulaC19H20N8
  • Average mass360.416 Da
  • Monoisotopic mass360.181091 Da
  • ChemSpider ID29446692

More details:






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

1,3-Propanediamine, N1-[1-methyl-6-(4-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N3-3-pyridinyl- [ACD/Index Name]
N-[1-Methyl-6-(4-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N'-(3-pyridinyl)-1,3-propandiamin [German] [ACD/IUPAC Name]
N-[1-Methyl-6-(4-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N'-(3-pyridinyl)-1,3-propanediamine [ACD/IUPAC Name]
N-[1-Méthyl-6-(4-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N'-(3-pyridinyl)-1,3-propanediamine [French] [ACD/IUPAC Name]
N-[1-methyl-6-(4-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-N'-3-pyridinyl-1,3-propanediamine

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 577.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.4±3.0 kJ/mol
Flash Point: 302.8±30.1 °C
Index of Refraction: 1.716
Molar Refractivity: 105.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -0.45
ACD/LogD (pH 5.5): 1.15
ACD/BCF (pH 5.5): 3.65
ACD/KOC (pH 5.5): 70.91
ACD/LogD (pH 7.4): 1.47
ACD/BCF (pH 7.4): 7.67
ACD/KOC (pH 7.4): 149.02
Polar Surface Area: 93 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 56.9±7.0 dyne/cm
Molar Volume: 267.2±7.0 cm3

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