ChemSpider 2D Image | GW4064 | C28H22Cl3NO4

GW4064

  • Molecular FormulaC28H22Cl3NO4
  • Average mass542.838 Da
  • Monoisotopic mass541.061462 Da
  • ChemSpider ID8069241
  • Double-bond stereo - Double-bond stereo


More details:






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

(E)-3-(2-chloro-4-((3-(2,6-dichlorophenyl)-5-isopropylisoxazol-4-yl)methoxy)styryl)benzoic acid
278779-30-9 [RN]
3-(2,6-Dichlorophenyl)-4-(3'-carboxy-2-chlorostilben-4-yl)oxymethyl-5-isopropylisoxazole
3-[(E)-2-(2-Chlor-4-{[3-(2,6-dichlorphenyl)-5-isopropyl-1,2-oxazol-4-yl]methoxy}phenyl)vinyl]benzoesäure [German] [ACD/IUPAC Name]
3-[(E)-2-(2-chloro-4-{[3-(2,6-dichlorophenyl)-5-(propan-2-yl)-1,2-oxazol-4-yl]methoxy}phenyl)ethenyl]benzoic acid
3-[(E)-2-(2-Chloro-4-{[3-(2,6-dichlorophenyl)-5-isopropyl-1,2-oxazol-4-yl]methoxy}phenyl)vinyl]benzoic acid [ACD/IUPAC Name]
3-[2-[2-chloro-4-[[3-(2,6-dichlorophenyl)-5-propan-2-yl-4-isoxazolyl]methoxy]phenyl]ethenyl]benzoic acid
Acide 3-[(E)-2-(2-chloro-4-{[3-(2,6-dichlorophényl)-5-isopropyl-1,2-oxazol-4-yl]méthoxy}phényl)vinyl]benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-[(E)-2-[2-chloro-4-[[3-(2,6-dichlorophenyl)-5-(1-methylethyl)-4-isoxazolyl]methoxy]phenyl]ethenyl]- [ACD/Index Name]
GW4064
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

C15635 [DBID]
GW 4064 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Safety:

      Sold for research purposes under agreement from GlaxoSmithKline Tocris Bioscience 2473
    • Target Organs:

      FXR agonist TargetMol T2233
    • Bio Activity:

      ; MedChem Express HY-50108
      Farnesoid X receptor TargetMol T2233
      FXR MedChem Express HY-50108
      GW 4064 is a selective, non-steroidal farnesoid X receptor (FXR) agonist (EC50 = 15 nM). MedChem Express
      GW 4064 is a selective, non-steroidal farnesoid X receptor (FXR) agonist (EC50 = 15 nM).; IC50 value: 15 nM (EC50) [1]; Target: FXR; in vitro: GW 4064 is a full agonist with EC50 values of 80 and 90 nM, respectively, in CV-1 cells transfected with mouse and human FXR expression vectors and an established reporter gene. MedChem Express HY-50108
      LXR-like Receptors Tocris Bioscience 2473
      Metabolism TargetMol T2233
      Nuclear Receptors Tocris Bioscience 2473
      Others MedChem Express HY-50108
      Selective farnesoid X receptor (FXR) agonist Tocris Bioscience 2473
      Selective, non-steroidal farnesoid X receptor (FXR) agonist (EC50 = 15 nM). Displays no activity at other nuclear receptors at concentrations up to 1 ?M. Improves hyperglycaemia and hyperlipidemia in diabetic db/db mice. Shown to suppress autophagy in nutrient-deprived mouse hepatocytes. Tocris Bioscience 2473
      Selective, non-steroidal farnesoid X receptor (FXR) agonist (EC50 = 15 nM). Displays no activity at other nuclear receptors at concentrations up to 1 ?M. Improves hyperglycaemia and hyperlipidemia in diabetic db/db mice. Shown to suppress autophagy in nutrient-deprived mouse hepatocytes. Tocris Bioscience 2473
      Selective, non-steroidal farnesoid X receptor (FXR) agonist (EC50 = 15 nM). Displays no activity at other nuclear receptors at concentrations up to 1 muM. Improves hyperglycaemia and hyperlipidemia in diabetic db/db mice. Shown to suppress autophagy in nutrient-deprived mouse hepatocytes. Tocris Bioscience 2473

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 702.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.9±3.0 kJ/mol
Flash Point: 378.4±32.9 °C
Index of Refraction: 1.654
Molar Refractivity: 145.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 8.49
ACD/LogD (pH 5.5): 7.03
ACD/BCF (pH 5.5): 61973.61
ACD/KOC (pH 5.5): 38891.03
ACD/LogD (pH 7.4): 5.49
ACD/BCF (pH 7.4): 1772.24
ACD/KOC (pH 7.4): 1112.16
Polar Surface Area: 73 Å2
Polarizability: 57.7±0.5 10-24cm3
Surface Tension: 54.1±3.0 dyne/cm
Molar Volume: 397.1±3.0 cm3

Click to predict properties on the Chemicalize site






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