ChemSpider 2D Image | 5-Methyl-1-(1-{3-[3-(trifluoromethyl)phenoxy]benzyl}-3-piperidinyl)-2,4(1H,3H)-pyrimidinedione | C24H24F3N3O3

5-Methyl-1-(1-{3-[3-(trifluoromethyl)phenoxy]benzyl}-3-piperidinyl)-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC24H24F3N3O3
  • Average mass459.461 Da
  • Monoisotopic mass459.176971 Da
  • ChemSpider ID28666046

More details:






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

2,4(1H,3H)-Pyrimidinedione, 5-methyl-1-[1-[[3-[3-(trifluoromethyl)phenoxy]phenyl]methyl]-3-piperidinyl]- [ACD/Index Name]
5-Methyl-1-(1-{3-[3-(trifluormethyl)phenoxy]benzyl}-3-piperidinyl)-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
5-Methyl-1-(1-{3-[3-(trifluoromethyl)phenoxy]benzyl}-3-piperidinyl)-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
5-Méthyl-1-(1-{3-[3-(trifluorométhyl)phénoxy]benzyl}-3-pipéridinyl)-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.569
Molar Refractivity: 115.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.50
ACD/LogD (pH 5.5): 0.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.83
ACD/LogD (pH 7.4): 2.22
ACD/BCF (pH 7.4): 14.03
ACD/KOC (pH 7.4): 99.22
Polar Surface Area: 62 Å2
Polarizability: 45.7±0.5 10-24cm3
Surface Tension: 45.6±3.0 dyne/cm
Molar Volume: 351.4±3.0 cm3

Click to predict properties on the Chemicalize site






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