ChemSpider 2D Image | 4-{(5S)-3-[4-Cyano-3-(trifluoromethyl)phenyl]-5-methyl-4-oxo-2-thioxo-1-imidazolidinyl}-2-fluoro-N-methylbenzamide | C20H14F4N4O2S

4-{(5S)-3-[4-Cyano-3-(trifluoromethyl)phenyl]-5-methyl-4-oxo-2-thioxo-1-imidazolidinyl}-2-fluoro-N-methylbenzamide

  • Molecular FormulaC20H14F4N4O2S
  • Average mass450.409 Da
  • Monoisotopic mass450.077362 Da
  • ChemSpider ID59004341

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

4-{(5S)-3-[4-Cyan-3-(trifluormethyl)phenyl]-5-methyl-4-oxo-2-thioxo-1-imidazolidinyl}-2-fluor-N-methylbenzamid [German] [ACD/IUPAC Name]
4-{(5S)-3-[4-Cyano-3-(trifluoromethyl)phenyl]-5-methyl-4-oxo-2-thioxo-1-imidazolidinyl}-2-fluoro-N-methylbenzamide [ACD/IUPAC Name]
4-{(5S)-3-[4-Cyano-3-(trifluorométhyl)phényl]-5-méthyl-4-oxo-2-thioxo-1-imidazolidinyl}-2-fluoro-N-méthylbenzamide [French] [ACD/IUPAC Name]
Benzamide, 4-[(5S)-3-[4-cyano-3-(trifluoromethyl)phenyl]-5-methyl-4-oxo-2-thioxo-1-imidazolidinyl]-2-fluoro-N-methyl- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.637
Molar Refractivity: 105.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.59
ACD/LogD (pH 5.5): 2.20
ACD/BCF (pH 5.5): 27.83
ACD/KOC (pH 5.5): 376.40
ACD/LogD (pH 7.4): 2.20
ACD/BCF (pH 7.4): 27.83
ACD/KOC (pH 7.4): 376.40
Polar Surface Area: 109 Å2
Polarizability: 41.9±0.5 10-24cm3
Surface Tension: 66.4±5.0 dyne/cm
Molar Volume: 294.1±5.0 cm3

Click to predict properties on the Chemicalize site


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