ChemSpider 2D Image | [1-(1,1-Dioxidotetrahydro-3-thiophenyl)-6-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-4-yl](4-morpholinyl)methanone | C22H23FN4O4S

[1-(1,1-Dioxidotetrahydro-3-thiophenyl)-6-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-4-yl](4-morpholinyl)methanone

  • Molecular FormulaC22H23FN4O4S
  • Average mass458.506 Da
  • Monoisotopic mass458.142395 Da
  • ChemSpider ID22341079

More details:

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

[1-(1,1-Dioxidotetrahydro-3-thiophenyl)-6-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-4-yl](4-morpholinyl)methanone [ACD/IUPAC Name]
[1-(1,1-Dioxidotetrahydro-3-thiophenyl)-6-(4-fluorphenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-4-yl](4-morpholinyl)methanon [German] [ACD/IUPAC Name]
[1-(1,1-Dioxydotétrahydro-3-thiophényl)-6-(4-fluorophényl)-3-méthyl-1H-pyrazolo[3,4-b]pyridin-4-yl](4-morpholinyl)méthanone [French] [ACD/IUPAC Name]
Methanone, [6-(4-fluorophenyl)-3-methyl-1-(tetrahydro-1,1-dioxido-3-thienyl)-1H-pyrazolo[3,4-b]pyridin-4-yl]-4-morpholinyl- [ACD/Index Name]
(1-(1,1-dioxidotetrahydrothiophen-3-yl)-6-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-4-yl)(morpholino)methanone
[1-(1,1-dioxothiolan-3-yl)-6-(4-fluorophenyl)-3-methylpyrazolo[3,4-b]pyridin-4-yl]-morpholin-4-ylmethanone
1021214-94-7 [RN]
3-[6-(4-fluorophenyl)-3-methyl-4-(morpholine-4-carbonyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]-1λ6-thiolane-1,1-dione
MFCD12004045

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

Density: 1.5±0.1 g/cm3
Boiling Point: 767.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.8±3.0 kJ/mol
Flash Point: 418.2±32.9 °C
Index of Refraction: 1.704
Molar Refractivity: 116.9±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.61
ACD/LogD (pH 5.5): 0.51
ACD/BCF (pH 5.5): 1.44
ACD/KOC (pH 5.5): 45.09
ACD/LogD (pH 7.4): 0.51
ACD/BCF (pH 7.4): 1.44
ACD/KOC (pH 7.4): 45.09
Polar Surface Area: 103 Å2
Polarizability: 46.3±0.5 10-24cm3
Surface Tension: 59.6±7.0 dyne/cm
Molar Volume: 301.0±7.0 cm3

Click to predict properties on the Chemicalize site


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