ChemSpider 2D Image | 1-(Cyclopentylmethyl)-N-methyl-3-[4-(4-methyl-1-piperazinyl)phenyl]-1H-pyrazolo[3,4-d]pyrimidin-6-amine | C23H31N7

1-(Cyclopentylmethyl)-N-methyl-3-[4-(4-methyl-1-piperazinyl)phenyl]-1H-pyrazolo[3,4-d]pyrimidin-6-amine

  • Molecular FormulaC23H31N7
  • Average mass405.539 Da
  • Monoisotopic mass405.264099 Da
  • ChemSpider ID88296174

More details:

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

(6E)-1-(Cyclopentylmethyl)-N-methyl-3-[4-(4-methyl-1-piperazinyl)phenyl]-1,5-dihydro-6H-pyrazolo[3,4-d]pyrimidin-6-imin [German] [ACD/IUPAC Name]
(6E)-1-(Cyclopentylmethyl)-N-methyl-3-[4-(4-methyl-1-piperazinyl)phenyl]-1,5-dihydro-6H-pyrazolo[3,4-d]pyrimidin-6-imine [ACD/IUPAC Name]
(6E)-1-(Cyclopentylméthyl)-N-méthyl-3-[4-(4-méthyl-1-pipérazinyl)phényl]-1,5-dihydro-6H-pyrazolo[3,4-d]pyrimidin-6-imine [French] [ACD/IUPAC Name]
1-(Cyclopentylmethyl)-N-methyl-3-[4-(4-methyl-1-piperazinyl)phenyl]-1H-pyrazolo[3,4-d]pyrimidin-6-amin [German] [ACD/IUPAC Name]
1-(Cyclopentylmethyl)-N-methyl-3-[4-(4-methyl-1-piperazinyl)phenyl]-1H-pyrazolo[3,4-d]pyrimidin-6-amine [ACD/IUPAC Name]
1-(Cyclopentylméthyl)-N-méthyl-3-[4-(4-méthyl-1-pipérazinyl)phényl]-1H-pyrazolo[3,4-d]pyrimidin-6-amine [French] [ACD/IUPAC Name]
1H-Pyrazolo[3,4-d]pyrimidin-6-amine, 1-(cyclopentylmethyl)-N-methyl-3-[4-(4-methyl-1-piperazinyl)phenyl]- [ACD/Index Name]
Methanamine, N-[(6E)-1-(cyclopentylmethyl)-1,5-dihydro-3-[4-(4-methyl-1-piperazinyl)phenyl]-6H-pyrazolo[3,4-d]pyrimidin-6-ylidene]- [ACD/Index Name]
1-(cyclopentylmethyl)-N-methyl-3-[4-(4-methylpiperazin-1-yl)phenyl]pyrazolo[3,4-d]pyrimidin-6-amine
eSM156
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 568.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.3±3.0 kJ/mol
Flash Point: 297.5±32.9 °C
Index of Refraction: 1.699
Molar Refractivity: 119.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.65
ACD/LogD (pH 5.5): -0.52
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.75
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.05
Polar Surface Area: 59 Å2
Polarizability: 47.4±0.5 10-24cm3
Surface Tension: 52.9±7.0 dyne/cm
Molar Volume: 309.5±7.0 cm3

Click to predict properties on the Chemicalize site


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