ChemSpider 2D Image | L-gamma-Glutamyl-S-[2-(4-hydroxyphenyl)-2-oxoethyl]cysteinylglycine | C18H23N3O8S

L-γ-Glutamyl-S-[2-(4-hydroxyphenyl)-2-oxoethyl]cysteinylglycine

  • Molecular FormulaC18H23N3O8S
  • Average mass441.456 Da
  • Monoisotopic mass441.120575 Da
  • ChemSpider ID23127800

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

Glycine, L-γ-glutamyl-S-[2-(4-hydroxyphenyl)-2-oxoethyl]cysteinyl- [ACD/Index Name]
L-γ-Glutamyl-S-[2-(4-hydroxyphenyl)-2-oxoethyl]cysteinylglycin [German] [ACD/IUPAC Name]
L-γ-Glutamyl-S-[2-(4-hydroxyphenyl)-2-oxoethyl]cysteinylglycine [ACD/IUPAC Name]
L-γ-Glutamyl-S-[2-(4-hydroxyphényl)-2-oxoéthyl]cystéinylglycine [French] [ACD/IUPAC Name]
2-Amino-4-{1-(carboxymethyl-carbamoyl)-2-[2-(4-hydroxy-phenyl)-2-oxo-ethylsulfanyl]-ethylcarbamoyl}-butyric acid
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL430738/

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

Density: 1.5±0.1 g/cm3
Boiling Point: 925.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 141.1±3.0 kJ/mol
Flash Point: 513.8±34.3 °C
Index of Refraction: 1.617
Molar Refractivity: 106.3±0.3 cm3
#H bond acceptors: 11
#H bond donors: 7
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 0.73
ACD/LogD (pH 5.5): -3.77
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.92
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 221 Å2
Polarizability: 42.1±0.5 10-24cm3
Surface Tension: 73.3±3.0 dyne/cm
Molar Volume: 304.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement