ChemSpider 2D Image | JNJ 5207787 | C32H38N4O2

JNJ 5207787

  • Molecular FormulaC32H38N4O2
  • Average mass510.670 Da
  • Monoisotopic mass510.299469 Da
  • ChemSpider ID8499546

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-N-(1-Acetyl-2,3-dihydro-1H-indol-6-yl)-3-(3-cyanophenyl)-N-[1-(2-cyclopentylethyl)-4-piperidinyl]acrylamide [ACD/IUPAC Name]
(2E)-N-(1-Acétyl-2,3-dihydro-1H-indol-6-yl)-3-(3-cyanophényl)-N-[1-(2-cyclopentyléthyl)-4-pipéridinyl]acrylamide [French] [ACD/IUPAC Name]
(2E)-N-(1-acetyl-2,3-dihydro-1H-indol-6-yl)-3-(3-cyanophenyl)-N-[1-(2-cyclopentylethyl)piperidin-4-yl]prop-2-enamide
(2E)-N-(1-Acetyl-2,3-dihydro-1H-indol-6-yl)-3-(3-cyanphenyl)-N-[1-(2-cyclopentylethyl)-4-piperidinyl]acrylamid [German] [ACD/IUPAC Name]
2-Propenamide, N-(1-acetyl-2,3-dihydro-1H-indol-6-yl)-3-(3-cyanophenyl)-N-[1-(2-cyclopentylethyl)-4-piperidinyl]-, (2E)- [ACD/Index Name]
683746-68-1 [RN]
JNJ 5207787
JNJ-5207787
(2E)-N-(1-Acetyl-2,3-dihydro-1H-indol-6-yl)-3-(3-cyanophenyl)-N-[1-(2-cyclopentylethyl)-4-piperidinyl]-2-propenamide
(E)-3-(3-cyanophenyl)-N-[1-(2-cyclopentylethyl)piperidin-4-yl]-N-(1-ethanoyl-2,3-dihydroindol-6-yl)prop-2-enamide
More...

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

OW44B6FA0Y [DBID]
UN2811 [DBID]
  • Experimental Physico-chemical Properties

    • Experimental Solubility:

      Soluble to 10 mM in DMSO and to 10 mM in ethanol Tocris Bioscience 4018
      Soluble to 10 mM in DMSO with gentle warming and to 10 mM in ethanol with gentle warming Tocris Bioscience 4018
  • Miscellaneous

    • Safety:

      Sold with the permission of Janssen Pharmaceutica N.V. Tocris Bioscience 4018

    • Bio Activity:

      7-TM Receptors Tocris Bioscience 4018
      NPY Receptors Tocris Bioscience 4018
      Peptide Receptors Tocris Bioscience 4018
      Selective NPY Y2 antagonist (IC50 = 0.1 ?M). Displays 100-fold selectivity over NPY Y1, Y4 and Y5 receptors; also displays selectivity against a panel of 50 receptors, ion channels and transporters. B rain penetrant. Tocris Bioscience 4018
      Selective NPY Y2 antagonist (IC50 = 0.1 ?M). Displays 100-fold selectivity over NPY Y1, Y4 and Y5 receptors; also displays selectivity against a panel of 50 receptors, ion channels and transporters. Brain penetrant. Tocris Bioscience 4018
      Selective NPY Y2 antagonist (IC50 = 0.1 muM). Displays 100-fold selectivity over NPY Y1, Y4 and Y5 receptors; also displays selectivity against a panel of 50 receptors, ion channels and transporters. Brain penetrant. Tocris Bioscience 4018
      Selective NPY Y2 receptor antagonist Tocris Bioscience 4018

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

Density: 1.2±0.1 g/cm3
Boiling Point: 727.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.2±3.0 kJ/mol
Flash Point: 393.9±32.9 °C
Index of Refraction: 1.635
Molar Refractivity: 149.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.84
ACD/LogD (pH 5.5): 2.00
ACD/BCF (pH 5.5): 4.29
ACD/KOC (pH 5.5): 16.48
ACD/LogD (pH 7.4): 3.62
ACD/BCF (pH 7.4): 180.66
ACD/KOC (pH 7.4): 693.58
Polar Surface Area: 68 Å2
Polarizability: 59.3±0.5 10-24cm3
Surface Tension: 60.8±5.0 dyne/cm
Molar Volume: 418.0±5.0 cm3

Click to predict properties on the Chemicalize site


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