ChemSpider 2D Image | 9-(2-Chlorophenyl)-N-[2-methoxy-4-(4-methyl-1-piperazinyl)phenyl]-8-methyl-6,8-dihydro-5H-pyrazolo[3,4-h]quinazolin-2-amine | C28H30ClN7O

9-(2-Chlorophenyl)-N-[2-methoxy-4-(4-methyl-1-piperazinyl)phenyl]-8-methyl-6,8-dihydro-5H-pyrazolo[3,4-h]quinazolin-2-amine

  • Molecular FormulaC28H30ClN7O
  • Average mass516.037 Da
  • Monoisotopic mass515.220032 Da
  • ChemSpider ID58952053

More details:

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

5H-Pyrazolo[3,4-h]quinazolin-2-amine, 9-(2-chlorophenyl)-6,8-dihydro-N-[2-methoxy-4-(4-methyl-1-piperazinyl)phenyl]-8-methyl- [ACD/Index Name]
9-(2-Chlorophenyl)-N-[2-methoxy-4-(4-methyl-1-piperazinyl)phenyl]-8-methyl-6,8-dihydro-5H-pyrazolo[3,4-h]quinazolin-2-amine [ACD/IUPAC Name]
9-(2-Chlorophényl)-N-[2-méthoxy-4-(4-méthyl-1-pipérazinyl)phényl]-8-méthyl-6,8-dihydro-5H-pyrazolo[3,4-h]quinazolin-2-amine [French] [ACD/IUPAC Name]
9-(2-Chlorphenyl)-N-[2-methoxy-4-(4-methyl-1-piperazinyl)phenyl]-8-methyl-6,8-dihydro-5H-pyrazolo[3,4-h]chinazolin-2-amin [German] [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: 744.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.5±3.0 kJ/mol
Flash Point: 403.9±35.7 °C
Index of Refraction: 1.703
Molar Refractivity: 145.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 4.54
ACD/LogD (pH 5.5): 2.72
ACD/BCF (pH 5.5): 21.38
ACD/KOC (pH 5.5): 78.17
ACD/LogD (pH 7.4): 4.39
ACD/BCF (pH 7.4): 987.61
ACD/KOC (pH 7.4): 3611.13
Polar Surface Area: 71 Å2
Polarizability: 57.8±0.5 10-24cm3
Surface Tension: 52.8±7.0 dyne/cm
Molar Volume: 376.0±7.0 cm3

Click to predict properties on the Chemicalize site


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