ChemSpider 2D Image | TUG 891 | C23H21FO3

TUG 891

  • Molecular FormulaC23H21FO3
  • Average mass364.409 Da
  • Monoisotopic mass364.147461 Da
  • ChemSpider ID28514850

More details:

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

1374516-07-0 [RN]
3-[4-({4-fluoro-4'-methyl-[1,1'-biphenyl]-2-yl}methoxy)phenyl]propanoic acid
3-{4-[(4-Fluor-4'-methyl-2-biphenylyl)methoxy]phenyl}propansäure [German] [ACD/IUPAC Name]
3-{4-[(4-Fluoro-4'-methyl-2-biphenylyl)methoxy]phenyl}propanoic acid [ACD/IUPAC Name]
Acide 3-{4-[(4-fluoro-4'-méthyl-2-biphénylyl)méthoxy]phényl}propanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, 4-[(4-fluoro-4'-methyl[1,1'-biphenyl]-2-yl)methoxy]- [ACD/Index Name]
TUG 891
TUG-891
[1374516-07-0] [RN]
3-(4-((4-Fluoro-4'-methyl-[1,1'-biphenyl]-2-yl)methoxy)phenyl)propanoic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]
PubChem Substance ID 329825761 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Safety:

      Sold under license from the University of Southern Denmark. Tocris Bioscience 4601

    • Bio Activity:

      7-TM Receptors Tocris Bioscience 4601
      Free Fatty Acid Receptors Tocris Bioscience 4601
      Potent and selective FFA4 (GPR120) agonist Tocris Bioscience 4601
      Potent FFA4 (GPR120) agonist (pEC50 values are 7.36 and 7.77 for human and mouse GPR120 respectively). Selective for GPR120 over free fatty acid receptors (pEC50 = 4.19 for FFA1; displays no activity at FFA2 or FFA3). Cell permeable. Tocris Bioscience 4601
      Potent FFA4 (GPR120) agonist (pEC50 values are 7.36 and 7.77 for human and mouse GPR120 respectively). Selective for GPR120 over free fatty acid receptors (pEC50 = 4.19 for FFA1; displays no activity at FFA2 or FFA3). Cell permeable. Tocris Bioscience 4601

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

Density: 1.2±0.1 g/cm3
Boiling Point: 540.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.1±3.0 kJ/mol
Flash Point: 280.9±30.1 °C
Index of Refraction: 1.590
Molar Refractivity: 102.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.56
ACD/LogD (pH 5.5): 4.33
ACD/BCF (pH 5.5): 717.39
ACD/KOC (pH 5.5): 2185.73
ACD/LogD (pH 7.4): 2.53
ACD/BCF (pH 7.4): 11.35
ACD/KOC (pH 7.4): 34.60
Polar Surface Area: 47 Å2
Polarizability: 40.7±0.5 10-24cm3
Surface Tension: 46.2±3.0 dyne/cm
Molar Volume: 303.9±3.0 cm3

Click to predict properties on the Chemicalize site


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