ChemSpider 2D Image | Bis(1,3-thiazol-5-ylmethyl) {(ethylimino)bis[(2S)-3-phenyl-1,2-propanediyl]}biscarbamate | C30H35N5O4S2

Bis(1,3-thiazol-5-ylmethyl) {(ethylimino)bis[(2S)-3-phenyl-1,2-propanediyl]}biscarbamate

  • Molecular FormulaC30H35N5O4S2
  • Average mass593.760 Da
  • Monoisotopic mass593.213074 Da
  • ChemSpider ID9788838

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

{(Éthylimino)bis[(2S)-3-phényl-1,2-propanediyl]}biscarbamate de bis(1,3-thiazol-5-ylméthyle) [French] [ACD/IUPAC Name]
Bis(1,3-thiazol-5-ylmethyl) {(ethylimino)bis[(2S)-3-phenyl-1,2-propanediyl]}biscarbamate [ACD/IUPAC Name]
Bis(1,3-thiazol-5-ylmethyl)-{(ethylimino)bis[(2S)-3-phenyl-1,2-propandiyl]}biscarbamat [German] [ACD/IUPAC Name]
Carbamic acid, N,N'-[(ethylimino)bis[(1S)-1-(phenylmethyl)-2,1-ethanediyl]]bis-, bis(5-thiazolylmethyl) ester [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: 777.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.1±3.0 kJ/mol
Flash Point: 423.8±32.9 °C
Index of Refraction: 1.614
Molar Refractivity: 162.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 2
ACD/LogP: 5.12
ACD/LogD (pH 5.5): 2.22
ACD/BCF (pH 5.5): 6.94
ACD/KOC (pH 5.5): 26.04
ACD/LogD (pH 7.4): 3.91
ACD/BCF (pH 7.4): 341.62
ACD/KOC (pH 7.4): 1281.47
Polar Surface Area: 162 Å2
Polarizability: 64.6±0.5 10-24cm3
Surface Tension: 56.0±3.0 dyne/cm
Molar Volume: 467.4±3.0 cm3

Click to predict properties on the Chemicalize site


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