ChemSpider 2D Image | N-(3-{[4-Amino-1-(Propan-2-Yl)-1h-Pyrazolo[3,4-D]pyrimidin-3-Yl]methyl}phenyl)ethanesulfonamide | C17H22N6O2S

N-(3-{[4-Amino-1-(Propan-2-Yl)-1h-Pyrazolo[3,4-D]pyrimidin-3-Yl]methyl}phenyl)ethanesulfonamide

  • Molecular FormulaC17H22N6O2S
  • Average mass374.461 Da
  • Monoisotopic mass374.152496 Da
  • ChemSpider ID26329314

More details:

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

N-(3-{[4-Amino-1-(Propan-2-Yl)-1h-Pyrazolo[3,4-D]pyrimidin-3-Yl]methyl}phenyl)ethanesulfonamide
Ethanesulfonamide, N-[3-[[4-amino-1-(1-methylethyl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]methyl]phenyl]- [ACD/Index Name]
N-{3-[(4-Amino-1-isopropyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl)methyl]phenyl}ethanesulfonamide [ACD/IUPAC Name]
N-{3-[(4-Amino-1-isopropyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl)méthyl]phényl}éthanesulfonamide [French] [ACD/IUPAC Name]
N-{3-[(4-Amino-1-isopropyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl)methyl]phenyl}ethansulfonamid [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: 584.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.3±3.0 kJ/mol
Flash Point: 307.1±32.9 °C
Index of Refraction: 1.684
Molar Refractivity: 100.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.65
ACD/LogD (pH 5.5): 1.67
ACD/BCF (pH 5.5): 10.59
ACD/KOC (pH 5.5): 182.94
ACD/LogD (pH 7.4): 1.68
ACD/BCF (pH 7.4): 10.87
ACD/KOC (pH 7.4): 187.72
Polar Surface Area: 124 Å2
Polarizability: 39.9±0.5 10-24cm3
Surface Tension: 56.3±7.0 dyne/cm
Molar Volume: 264.8±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement