ChemSpider 2D Image | WWL70 | C27H23N3O3

WWL70

  • Molecular FormulaC27H23N3O3
  • Average mass437.490 Da
  • Monoisotopic mass437.173950 Da
  • ChemSpider ID21467812

More details:






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

4'-Carbamoyl-4-biphenylyl methyl[3-(4-pyridinyl)benzyl]carbamate [ACD/IUPAC Name]
4'-Carbamoyl-4-biphenylyl-methyl[3-(4-pyridinyl)benzyl]carbamat [German] [ACD/IUPAC Name]
4'-Carbamoylbiphenyl-4-yl methyl(3-(pyridin-4-yl)benzyl)carbamate
947669-91-2 [RN]
Carbamic acid, N-methyl-N-[[3-(4-pyridinyl)phenyl]methyl]-, 4'-(aminocarbonyl)[1,1'-biphenyl]-4-yl ester [ACD/Index Name]
Méthyl[3-(4-pyridinyl)benzyl]carbamate de 4'-carbamoyl-4-biphénylyle [French] [ACD/IUPAC Name]
MFCD10567112
N-methyl-N-[[3-(4-pyridinyl)phenyl]methyl]-4'-(aminocarbonyl)[1,1'-biphenyl]-4-yl ester carbamic acid
WWL70
WWL-70
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  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Bio Activity:

      Enzymes Tocris Bioscience 3252
      Hydrolases Tocris Bioscience 3252
      Other Hydrolases Tocris Bioscience 3252
      Potent ABHD6 inhibitor Tocris Bioscience 3252
      Potent inhibitor of ?/?-hydrolase domain 6 (ABHD6) (IC50 = 70 nM), an enzyme which catalyzes the hydrolysis of 2-arachidonylglycerol (Cat. No. 1298). Tocris Bioscience 3252
      Potent inhibitor of alpha/beta-hydrolase domain 6 (ABHD6) (IC50 = 70 nM), an enzyme which catalyzes the hydrolysis of 2-arachidonylglycerol (Cat. No. 1298). Tocris Bioscience 3252

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

Density: 1.2±0.1 g/cm3
Boiling Point: 653.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.2±3.0 kJ/mol
Flash Point: 348.8±31.5 °C
Index of Refraction: 1.634
Molar Refractivity: 126.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.82
ACD/LogD (pH 5.5): 4.13
ACD/BCF (pH 5.5): 744.23
ACD/KOC (pH 5.5): 3578.65
ACD/LogD (pH 7.4): 4.28
ACD/BCF (pH 7.4): 1052.64
ACD/KOC (pH 7.4): 5061.66
Polar Surface Area: 86 Å2
Polarizability: 50.2±0.5 10-24cm3
Surface Tension: 54.5±3.0 dyne/cm
Molar Volume: 354.0±3.0 cm3

Click to predict properties on the Chemicalize site






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