ChemSpider 2D Image | (5S)-5-Methyl-5-[(1S)-3-oxo-1-phenylbutyl]-3-phenyl-2-thioxo-1,3-thiazolidin-4-one | C20H19NO2S2

(5S)-5-Methyl-5-[(1S)-3-oxo-1-phenylbutyl]-3-phenyl-2-thioxo-1,3-thiazolidin-4-one

  • Molecular FormulaC20H19NO2S2
  • Average mass369.500 Da
  • Monoisotopic mass369.085724 Da
  • ChemSpider ID30651853

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(5S)-5-Methyl-5-[(1S)-3-oxo-1-phenylbutyl]-3-phenyl-2-thioxo-1,3-thiazolidin-4-on [German] [ACD/IUPAC Name]
(5S)-5-Methyl-5-[(1S)-3-oxo-1-phenylbutyl]-3-phenyl-2-thioxo-1,3-thiazolidin-4-one [ACD/IUPAC Name]
(5S)-5-Méthyl-5-[(1S)-3-oxo-1-phénylbutyl]-3-phényl-2-thioxo-1,3-thiazolidin-4-one [French] [ACD/IUPAC Name]
4-Thiazolidinone, 5-methyl-5-[(1S)-3-oxo-1-phenylbutyl]-3-phenyl-2-thioxo-, (5S)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 491.5±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.8±3.0 kJ/mol
Flash Point: 251.1±26.5 °C
Index of Refraction: 1.671
Molar Refractivity: 105.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.71
ACD/LogD (pH 5.5): 3.38
ACD/BCF (pH 5.5): 219.78
ACD/KOC (pH 5.5): 1651.98
ACD/LogD (pH 7.4): 3.38
ACD/BCF (pH 7.4): 219.78
ACD/KOC (pH 7.4): 1651.98
Polar Surface Area: 95 Å2
Polarizability: 41.9±0.5 10-24cm3
Surface Tension: 63.7±5.0 dyne/cm
Molar Volume: 282.6±5.0 cm3

Click to predict properties on the Chemicalize site


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