ChemSpider 2D Image | N-{1-[2-(Dimethylamino)ethyl]-1H-pyrazol-3-yl}-8-methyl-9-(3-methyl-2-thienyl)-6,8-dihydro-5H-pyrazolo[3,4-h]quinazolin-2-amine | C22H26N8S

N-{1-[2-(Dimethylamino)ethyl]-1H-pyrazol-3-yl}-8-methyl-9-(3-methyl-2-thienyl)-6,8-dihydro-5H-pyrazolo[3,4-h]quinazolin-2-amine

  • Molecular FormulaC22H26N8S
  • Average mass434.560 Da
  • Monoisotopic mass434.200104 Da
  • ChemSpider ID58952238

More details:

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

5H-Pyrazolo[3,4-h]quinazolin-2-amine, N-[1-[2-(dimethylamino)ethyl]-1H-pyrazol-3-yl]-6,8-dihydro-8-methyl-9-(3-methyl-2-thienyl)- [ACD/Index Name]
N-{1-[2-(Dimethylamino)ethyl]-1H-pyrazol-3-yl}-8-methyl-9-(3-methyl-2-thienyl)-6,8-dihydro-5H-pyrazolo[3,4-h]chinazolin-2-amin [German] [ACD/IUPAC Name]
N-{1-[2-(Dimethylamino)ethyl]-1H-pyrazol-3-yl}-8-methyl-9-(3-methyl-2-thienyl)-6,8-dihydro-5H-pyrazolo[3,4-h]quinazolin-2-amine [ACD/IUPAC Name]
N-{1-[2-(Diméthylamino)éthyl]-1H-pyrazol-3-yl}-8-méthyl-9-(3-méthyl-2-thiényl)-6,8-dihydro-5H-pyrazolo[3,4-h]quinazolin-2-amine [French] [ACD/IUPAC 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: 658.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.9±3.0 kJ/mol
Flash Point: 352.1±34.3 °C
Index of Refraction: 1.740
Molar Refractivity: 125.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.64
ACD/LogD (pH 5.5): 0.82
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.12
ACD/LogD (pH 7.4): 2.26
ACD/BCF (pH 7.4): 13.49
ACD/KOC (pH 7.4): 85.10
Polar Surface Area: 105 Å2
Polarizability: 49.7±0.5 10-24cm3
Surface Tension: 56.0±7.0 dyne/cm
Molar Volume: 310.9±7.0 cm3

Click to predict properties on the Chemicalize site


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