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Search term: N[C@@H](CCC(=O)N[C@@H](CSCC(=O)c1ccc(cc1)[N+]([O-])=O)C(=O)NCC(O)=O)C(O)=O (Found by conversion of search term to chemical structure (full match))
ChemSpider 2D Image | L-gamma-Glutamyl-S-[2-(4-nitrophenyl)-2-oxoethyl]-L-cysteinylglycine | C18H22N4O9S

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

  • Molecular FormulaC18H22N4O9S
  • Average mass470.454 Da
  • Monoisotopic mass470.110748 Da
  • ChemSpider ID35033714

  • 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-[2-(4-nitrophenyl)-2-oxoethyl]-L-cysteinyl- [ACD/Index Name]
L-γ-Glutamyl-S-[2-(4-nitrophenyl)-2-oxoethyl]-L-cysteinylglycin [German] [ACD/IUPAC Name]
L-γ-Glutamyl-S-[2-(4-nitrophenyl)-2-oxoethyl]-L-cysteinylglycine [ACD/IUPAC Name]
L-γ-Glutamyl-S-[2-(4-nitrophényl)-2-oxoéthyl]-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: 902.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 137.4±3.0 kJ/mol
Flash Point: 499.4±34.3 °C
Index of Refraction: 1.616
Molar Refractivity: 111.0±0.3 cm3
#H bond acceptors: 13
#H bond donors: 6
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 0.72
ACD/LogD (pH 5.5): -3.73
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 247 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 73.7±3.0 dyne/cm
Molar Volume: 317.4±3.0 cm3

Click to predict properties on the Chemicalize site


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