ChemSpider 2D Image | N-(4-{4-Amino-1-[1-(tetrahydro-2H-pyran-4-yl)-4-piperidinyl]-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methoxyphenyl)-1-methyl-1H-indole-2-carboxamide | C32H36N8O3

N-(4-{4-Amino-1-[1-(tetrahydro-2H-pyran-4-yl)-4-piperidinyl]-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methoxyphenyl)-1-methyl-1H-indole-2-carboxamide

  • Molecular FormulaC32H36N8O3
  • Average mass580.680 Da
  • Monoisotopic mass580.291016 Da
  • ChemSpider ID7828107

More details:






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

1H-Indole-2-carboxamide, N-[4-[4-amino-1-[1-(tetrahydro-2H-pyran-4-yl)-4-piperidinyl]-1H-pyrazolo[3,4-d]pyrimidin-3-yl]-2-methoxyphenyl]-1-methyl- [ACD/Index Name]
N-(4-{4-Amino-1-[1-(tetrahydro-2H-pyran-4-yl)-4-piperidinyl]-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methoxyphenyl)-1-methyl-1H-indol-2-carboxamid [German] [ACD/IUPAC Name]
N-(4-{4-Amino-1-[1-(tetrahydro-2H-pyran-4-yl)-4-piperidinyl]-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methoxyphenyl)-1-methyl-1H-indole-2-carboxamide [ACD/IUPAC Name]
N-(4-{4-Amino-1-[1-(tétrahydro-2H-pyran-4-yl)-4-pipéridinyl]-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-méthoxyphényl)-1-méthyl-1H-indole-2-carboxamide [French] [ACD/IUPAC Name]
N-(4-{4-Amino-1-[1-(Tetrahydro-2h-Pyran-4-Yl)piperidin-4-Yl]-1h-Pyrazolo[3,4-D]pyrimidin-3-Yl}-2-Methoxyphenyl)-1-Methyl-1h-Indole-2-Carboxamide
A-641359
CHEMBL381203
L3G

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

Density: 1.4±0.1 g/cm3
Boiling Point: 756.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.3±3.0 kJ/mol
Flash Point: 411.6±32.9 °C
Index of Refraction: 1.732
Molar Refractivity: 161.4±0.5 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 4.17
ACD/LogD (pH 5.5): 1.40
ACD/BCF (pH 5.5): 1.89
ACD/KOC (pH 5.5): 11.95
ACD/LogD (pH 7.4): 3.12
ACD/BCF (pH 7.4): 97.92
ACD/KOC (pH 7.4): 619.06
Polar Surface Area: 125 Å2
Polarizability: 64.0±0.5 10-24cm3
Surface Tension: 60.1±7.0 dyne/cm
Molar Volume: 403.6±7.0 cm3

Click to predict properties on the Chemicalize site






Advertisement