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Search term: KALPXWYCCNQTJQ (Found by InChIKey (skeleton match))

ChemSpider 2D Image | L-gamma-Glutamyl-S-(4-nitrobenzoyl)-L-cysteinylglycine | C17H20N4O9S

L-γ-Glutamyl-S-(4-nitrobenzoyl)-L-cysteinylglycine

  • Molecular FormulaC17H20N4O9S
  • Average mass456.427 Da
  • Monoisotopic mass456.095093 Da
  • ChemSpider ID75550924
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

Glycine, L-γ-glutamyl-S-(4-nitrobenzoyl)-L-cysteinyl- [ACD/Index Name]
L-γ-Glutamyl-S-(4-nitrobenzoyl)-L-cysteinylglycin [German] [ACD/IUPAC Name]
L-γ-Glutamyl-S-(4-nitrobenzoyl)-L-cysteinylglycine [ACD/IUPAC Name]
L-γ-Glutamyl-S-(4-nitrobenzoyl)-L-cystéinylglycine [French] [ACD/IUPAC 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: 885.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 134.8±3.0 kJ/mol
Flash Point: 489.1±34.3 °C
Index of Refraction: 1.625
Molar Refractivity: 106.3±0.3 cm3
#H bond acceptors: 13
#H bond donors: 6
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 0.84
ACD/LogD (pH 5.5): -3.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 247 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 76.6±3.0 dyne/cm
Molar Volume: 300.9±3.0 cm3

Click to predict properties on the Chemicalize site






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