ChemSpider 2D Image | (4S,5S)-5-(4-Chlorophenyl)-N-[(2,2,6,6-~2~H_4_)cyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide | C17H17D4ClN2O2S

(4S,5S)-5-(4-Chlorophenyl)-N-[(2,2,6,6-2H4)cyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide

  • Molecular FormulaC17H17D4ClN2O2S
  • Average mass356.904 Da
  • Monoisotopic mass356.126343 Da
  • ChemSpider ID34451988

  • defined stereocentres - 2 of 2 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(4S,5S)-5-(4-Chlorophenyl)-N-[(2,2,6,6-2H4)cyclohexyl]-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide [ACD/IUPAC Name]
(4S,5S)-5-(4-Chlorophényl)-N-[(2,2,6,6-2H4)cyclohexyl]-4-méthyl-2-oxo-1,3-thiazolidine-3-carboxamide [French] [ACD/IUPAC Name]
(4S,5S)-5-(4-Chlorphenyl)-N-[(2,2,6,6-2H4)cyclohexyl]-4-methyl-2-oxo-1,3-thiazolidin-3-carboxamid [German] [ACD/IUPAC Name]
3-Thiazolidinecarboxamide, 5-(4-chlorophenyl)-N-(cyclohexyl-2,2,6,6-d4)-4-methyl-2-oxo-, (4S,5S)- [ACD/Index Name]
(4S,5S)-5-(4-chlorophenyl)-4-methyl-2-oxo-N-(2,2,6,6-tetradeuteriocyclohexyl)thiazolidine-3-carboxamide

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: 1.621
Molar Refractivity: 94.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.41
ACD/LogD (pH 5.5): 3.71
ACD/BCF (pH 5.5): 385.86
ACD/KOC (pH 5.5): 2471.56
ACD/LogD (pH 7.4): 3.71
ACD/BCF (pH 7.4): 385.86
ACD/KOC (pH 7.4): 2471.55
Polar Surface Area: 75 Å2
Polarizability: 37.3±0.5 10-24cm3
Surface Tension: 56.5±5.0 dyne/cm
Molar Volume: 267.6±5.0 cm3

Click to predict properties on the Chemicalize site


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