ChemSpider 2D Image | 4-fluoro-N-[(1R)-1-[1-(oxane-4-carbonyl)-2,3-dihydroindol-5-yl]ethyl]benzamide | C23H25FN2O3

4-fluoro-N-[(1R)-1-[1-(oxane-4-carbonyl)-2,3-dihydroindol-5-yl]ethyl]benzamide

  • Molecular FormulaC23H25FN2O3
  • Average mass396.455 Da
  • Monoisotopic mass396.184906 Da
  • ChemSpider ID72380082

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2166616-75-5 [RN]
4-Fluor-N-{(1R)-1-[1-(tetrahydro-2H-pyran-4-ylcarbonyl)-2,3-dihydro-1H-indol-5-yl]ethyl}benzamid [German] [ACD/IUPAC Name]
4-fluoro-N-[(1R)-1-[1-(oxane-4-carbonyl)-2,3-dihydro-1H-indol-5-yl]ethyl]benzamide
4-fluoro-N-[(1R)-1-[1-(oxane-4-carbonyl)-2,3-dihydroindol-5-yl]ethyl]benzamide
4-Fluoro-N-{(1R)-1-[1-(tetrahydro-2H-pyran-4-ylcarbonyl)-2,3-dihydro-1H-indol-5-yl]ethyl}benzamide [ACD/IUPAC Name]
4-Fluoro-N-{(1R)-1-[1-(tétrahydro-2H-pyran-4-ylcarbonyl)-2,3-dihydro-1H-indol-5-yl]éthyl}benzamide [French] [ACD/IUPAC Name]
Benzamide, N-[(1R)-1-[2,3-dihydro-1-[(tetrahydro-2H-pyran-4-yl)carbonyl]-1H-indol-5-yl]ethyl]-4-fluoro- [ACD/Index Name]
IDO1-IN-5
N-[(1R)-1-[2,3-dihydro-1-[(tetrahydro-2H-pyran-4-yl)carbonyl]-1H-indol-5-yl]ethyl]-4-fluoro-benzamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 665.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.9±3.0 kJ/mol
Flash Point: 356.3±31.5 °C
Index of Refraction: 1.593
Molar Refractivity: 107.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.73
ACD/LogD (pH 5.5): 3.44
ACD/BCF (pH 5.5): 240.60
ACD/KOC (pH 5.5): 1762.50
ACD/LogD (pH 7.4): 3.44
ACD/BCF (pH 7.4): 240.61
ACD/KOC (pH 7.4): 1762.58
Polar Surface Area: 59 Å2
Polarizability: 42.6±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 316.9±3.0 cm3

Click to predict properties on the Chemicalize site


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