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Search term: XCHIZTUBUXZESJ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | WAY-317,538 | C20H25N3O2

WAY-317,538

  • Molecular FormulaC20H25N3O2
  • Average mass339.431 Da
  • Monoisotopic mass339.194672 Da
  • ChemSpider ID24663034

More details:

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

4-Morpholinepentanamide, N-[4-(3-pyridinyl)phenyl]- [ACD/Index Name]
5-(4-Morpholinyl)-N-[4-(3-pyridinyl)phenyl]pentanamid [German] [ACD/IUPAC Name]
5-(4-Morpholinyl)-N-[4-(3-pyridinyl)phenyl]pentanamide [ACD/IUPAC Name]
5-(4-Morpholinyl)-N-[4-(3-pyridinyl)phényl]pentanamide [French] [ACD/IUPAC Name]
5-(Morpholin-4-yl)-N-[4-(pyridin-3-yl)phenyl]pentanamide
874450-44-9 [RN]
SEN-12333
WAY 317538
WAY-317,538 [Wiki]
[874450-44-9] [RN]
More...
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Bio Activity:

      ?7 nAChR agonist; histamine H3 antagonist Tocris Bioscience 4441
      ?7 nicotinic acetylcholine receptor (nAChR) agonist (EC50 = 1.6 ?M, Ki = 260 nM at rat ?7 nAChRs). Also displays functional antagonism at histamine H3 receptors (IC50 = 103 nM) and weak agonist activi ty at human ganglionic ?3 nAChRs (IC50 = 8.5 ?M). Neuroprotective in a rodent model of quisqualic acid-induced cholinergic degeneration. Brain penetrant and orally bioavailable. Tocris Bioscience 4441
      ?7 nicotinic acetylcholine receptor (nAChR) agonist (EC50 = 1.6 ?M, Ki = 260 nM at rat ?7 nAChRs). Also displays functional antagonism at histamine H3 receptors (IC50 = 103 nM) and weak agonist activity at human ganglionic ?3 nAChRs (IC50 = 8.5 ?M). Neuroprotective in a rodent model of quisqualic acid-induced cholinergic degeneration. Brain penetrant and orally bioavailable. Tocris Bioscience 4441
      Acetylcholine (Nicotinic) Receptors Tocris Bioscience 4441
      alpha7 nAChR agonist; histamine H3 antagonist Tocris Bioscience 4441
      alpha7 nicotinic acetylcholine receptor (nAChR) agonist (EC50 = 1.6 muM, Ki = 260 nM at rat alpha7 nAChRs). Also displays functional antagonism at histamine H3 receptors (IC50 = 103 nM) and weak agonist activity at human ganglionic alpha3 nAChRs (IC50 = 8.5 muM). Neuroprotective in a rodent model of quisqualic acid-induced cholinergic degeneration. Brain penetrant and orally bioavailable. Tocris Bioscience 4441
      Ion Channels Tocris Bioscience 4441
      Ligand-gated Ion Channels Tocris Bioscience 4441

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

Density: 1.1±0.1 g/cm3
Boiling Point: 569.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.4±3.0 kJ/mol
Flash Point: 298.2±30.1 °C
Index of Refraction: 1.584
Molar Refractivity: 98.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.11
ACD/LogD (pH 5.5): 0.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.44
ACD/LogD (pH 7.4): 2.03
ACD/BCF (pH 7.4): 17.25
ACD/KOC (pH 7.4): 217.45
Polar Surface Area: 54 Å2
Polarizability: 39.1±0.5 10-24cm3
Surface Tension: 49.4±3.0 dyne/cm
Molar Volume: 295.1±3.0 cm3

Click to predict properties on the Chemicalize site


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