ChemSpider 2D Image | RPR260243 | C28H25F3N2O4

RPR260243

  • Molecular FormulaC28H25F3N2O4
  • Average mass510.504 Da
  • Monoisotopic mass510.176636 Da
  • ChemSpider ID9641195

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3R,4R)-4-[3-(6-Methoxy-4-chinolinyl)-3-oxopropyl]-1-[3-(2,3,5-trifluorphenyl)-2-propin-1-yl]-3-piperidincarbonsäure [German] [ACD/IUPAC Name]
(3R,4R)-4-[3-(6-Methoxy-4-quinolinyl)-3-oxopropyl]-1-[3-(2,3,5-trifluorophenyl)-2-propyn-1-yl]-3-piperidinecarboxylic acid [ACD/IUPAC Name]
(3R,4R)-4-[3-(6-methoxyquinolin-4-yl)-3-oxopropyl]-1-[3-(2,3,5-trifluorophenyl)prop-2-yn-1-yl]piperidine-3-carboxylic acid
3-Piperidinecarboxylic acid, 4-[3-(6-methoxy-4-quinolinyl)-3-oxopropyl]-1-[3-(2,3,5-trifluorophenyl)-2-propyn-1-yl]-, (3R,4R)- [ACD/Index Name]
Acide (3R,4R)-4-[3-(6-méthoxy-4-quinoléinyl)-3-oxopropyl]-1-[3-(2,3,5-trifluorophényl)-2-propyn-1-yl]-3-pipéridinecarboxylique [French] [ACD/IUPAC Name]
RPR260243
(3R,4R)-4-[3-(6-methoxyquinolin-4-yl)-3-oxopropyl]-1-[3-(2,3,5-trifluorophenyl)prop-2-ynyl]piperidine-3-carboxylic acid
(3R,4R)-4-[3-(6-methoxyquinolin-4-yl)-3-oxo-propyl]-1-[3-(2,3,5-trifluoro-phenyl)-prop-2-ynyl]-piperidine-3-carboxylic acid
[(3R,4R)-4-[3-(6-methoxy-quinolin-4-yl)-3-oxo-propyl]-1-[3-(2,3,5-trifluorophenyl)-prop-2-ynyl]-piperidine-3-carboxylic acid]
[668463-35-2] [RN]
More...
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Bio Activity:

      Membrane Tranporter/Ion Channel; MedChem Express HY-16915
      Potassium Channel MedChem Express HY-16915
      RPR-260243 is a novel activator of HERG; modifies HERG currents inhibited by dofetilide (IC50 = 58 nM); little effect on HERG current amplitude and no significant effects on steady-state activation pa rameters or on channel inactivation processes. MedChem Express

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

Density: 1.4±0.1 g/cm3
Boiling Point: 668.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 103.2±3.0 kJ/mol
Flash Point: 357.8±31.5 °C
Index of Refraction: 1.625
Molar Refractivity: 130.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.48
ACD/LogD (pH 5.5): 2.54
ACD/BCF (pH 5.5): 13.38
ACD/KOC (pH 5.5): 46.81
ACD/LogD (pH 7.4): 2.32
ACD/BCF (pH 7.4): 8.09
ACD/KOC (pH 7.4): 28.30
Polar Surface Area: 80 Å2
Polarizability: 51.8±0.5 10-24cm3
Surface Tension: 61.8±5.0 dyne/cm
Molar Volume: 369.8±5.0 cm3

Click to predict properties on the Chemicalize site


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