ChemSpider 2D Image | N-[2-Methoxy-4-(4-methyl-1-piperazinyl)phenyl]-9-[methoxy(phenyl)methyl]-8-methyl-6,8-dihydro-5H-pyrazolo[3,4-h]quinazolin-2-amine | C30H35N7O2

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

  • Molecular FormulaC30H35N7O2
  • Average mass525.645 Da
  • Monoisotopic mass525.285217 Da
  • ChemSpider ID58904718

More details:

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

5H-Pyrazolo[3,4-h]quinazolin-2-amine, 6,8-dihydro-N-[2-methoxy-4-(4-methyl-1-piperazinyl)phenyl]-9-(methoxyphenylmethyl)-8-methyl- [ACD/Index Name]
N-[2-Methoxy-4-(4-methyl-1-piperazinyl)phenyl]-9-[methoxy(phenyl)methyl]-8-methyl-6,8-dihydro-5H-pyrazolo[3,4-h]chinazolin-2-amin [German] [ACD/IUPAC Name]
N-[2-Methoxy-4-(4-methyl-1-piperazinyl)phenyl]-9-[methoxy(phenyl)methyl]-8-methyl-6,8-dihydro-5H-pyrazolo[3,4-h]quinazolin-2-amine [ACD/IUPAC Name]
N-[2-Méthoxy-4-(4-méthyl-1-pipérazinyl)phényl]-9-[méthoxy(phényl)méthyl]-8-méthyl-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: 1.3±0.1 g/cm3
Boiling Point: 731.7±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.8±3.0 kJ/mol
Flash Point: 396.3±35.7 °C
Index of Refraction: 1.673
Molar Refractivity: 151.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.89
ACD/LogD (pH 5.5): 2.54
ACD/BCF (pH 5.5): 15.55
ACD/KOC (pH 5.5): 62.19
ACD/LogD (pH 7.4): 4.20
ACD/BCF (pH 7.4): 719.23
ACD/KOC (pH 7.4): 2876.73
Polar Surface Area: 81 Å2
Polarizability: 60.1±0.5 10-24cm3
Surface Tension: 49.7±7.0 dyne/cm
Molar Volume: 404.4±7.0 cm3

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