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Search term: PARUULGUCQEWNM (Found by InChIKey (skeleton match))

ChemSpider 2D Image | N-{5-[(1-Cycloheptyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)amino]-2-pyridinyl}methanesulfonamide | C18H23N7O2S

N-{5-[(1-Cycloheptyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)amino]-2-pyridinyl}methanesulfonamide

  • Molecular FormulaC18H23N7O2S
  • Average mass401.486 Da
  • Monoisotopic mass401.163391 Da
  • ChemSpider ID26326516

More details:






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

Methanesulfonamide, N-[5-[(1-cycloheptyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)amino]-2-pyridinyl]- [ACD/Index Name]
N-{5-[(1-Cycloheptyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)amino]-2-pyridinyl}methanesulfonamide [ACD/IUPAC Name]
N-{5-[(1-Cycloheptyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)amino]-2-pyridinyl}méthanesulfonamide [French] [ACD/IUPAC Name]
N-{5-[(1-Cycloheptyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)amino]-2-pyridinyl}methansulfonamid [German] [ACD/IUPAC Name]
N-{5-[(1-Cycloheptyl-1h-Pyrazolo[3,4-D]pyrimidin-6-Yl)amino]pyridin-2-Yl}methanesulfonamide
D37

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

Density: 1.5±0.1 g/cm3
Boiling Point: 643.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.9±3.0 kJ/mol
Flash Point: 342.9±34.3 °C
Index of Refraction: 1.736
Molar Refractivity: 107.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.33
ACD/LogD (pH 5.5): 1.96
ACD/BCF (pH 5.5): 17.60
ACD/KOC (pH 5.5): 261.70
ACD/LogD (pH 7.4): 1.02
ACD/BCF (pH 7.4): 2.01
ACD/KOC (pH 7.4): 29.88
Polar Surface Area: 123 Å2
Polarizability: 42.5±0.5 10-24cm3
Surface Tension: 64.8±7.0 dyne/cm
Molar Volume: 266.7±7.0 cm3

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