ChemSpider 2D Image | 6-Methyl-5-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}ethyl)-2,4(1H,3H)-pyrimidinedione | C18H19F3N4O3

6-Methyl-5-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}ethyl)-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC18H19F3N4O3
  • Average mass396.364 Da
  • Monoisotopic mass396.140930 Da
  • ChemSpider ID26294572

More details:

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

2,4(1H,3H)-Pyrimidinedione, 6-methyl-5-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl]- [ACD/Index Name]
6-Methyl-5-(2-oxo-2-{4-[3-(trifluormethyl)phenyl]-1-piperazinyl}ethyl)-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
6-Methyl-5-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}ethyl)-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
6-Méthyl-5-(2-oxo-2-{4-[3-(trifluorométhyl)phényl]-1-pipérazinyl}éthyl)-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
1203091-03-5 [RN]
6-methyl-5-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)pyrimidine-2,4(1H,3H)-dione

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.537
Molar Refractivity: 91.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.48
ACD/LogD (pH 5.5): 1.92
ACD/BCF (pH 5.5): 17.09
ACD/KOC (pH 5.5): 265.48
ACD/LogD (pH 7.4): 1.91
ACD/BCF (pH 7.4): 16.64
ACD/KOC (pH 7.4): 258.43
Polar Surface Area: 82 Å2
Polarizability: 36.4±0.5 10-24cm3
Surface Tension: 42.7±3.0 dyne/cm
Molar Volume: 294.3±3.0 cm3

Click to predict properties on the Chemicalize site


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