ChemSpider 2D Image | Tert-Butyl {4-[4-Amino-1-(Propan-2-Yl)-1h-Pyrazolo[3,4-D]pyrimidin-3-Yl]-2-Methoxyphenyl}carbamate | C20H26N6O3

Tert-Butyl {4-[4-Amino-1-(Propan-2-Yl)-1h-Pyrazolo[3,4-D]pyrimidin-3-Yl]-2-Methoxyphenyl}carbamate

  • Molecular FormulaC20H26N6O3
  • Average mass398.459 Da
  • Monoisotopic mass398.206635 Da
  • ChemSpider ID24605310

More details:

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

[4-(4-Amino-1-isopropyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl)-2-méthoxyphényl]carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl [4-(4-amino-1-isopropyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl)-2-methoxyphenyl]carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[4-(4-amino-1-isopropyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl)-2-methoxyphenyl]carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[4-[4-amino-1-(1-methylethyl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]-2-methoxyphenyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
Tert-Butyl {4-[4-Amino-1-(Propan-2-Yl)-1h-Pyrazolo[3,4-D]pyrimidin-3-Yl]-2-Methoxyphenyl}carbamate
tert-butyl 4-(4-amino-1-isopropyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl)-2-methoxyphenylcarbamate
VSH

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 543.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.1±3.0 kJ/mol
Flash Point: 282.2±30.1 °C
Index of Refraction: 1.626
Molar Refractivity: 108.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.25
ACD/LogD (pH 5.5): 3.01
ACD/BCF (pH 5.5): 113.05
ACD/KOC (pH 5.5): 1013.11
ACD/LogD (pH 7.4): 3.03
ACD/BCF (pH 7.4): 118.31
ACD/KOC (pH 7.4): 1060.21
Polar Surface Area: 117 Å2
Polarizability: 42.9±0.5 10-24cm3
Surface Tension: 46.1±7.0 dyne/cm
Molar Volume: 305.7±7.0 cm3

Click to predict properties on the Chemicalize site


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