ChemSpider 2D Image | gamma-Glutamyl-S-[4-(ethylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl]-L-cysteinylglycine | C18H30N8O6S

γ-Glutamyl-S-[4-(ethylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl]-L-cysteinylglycine

  • Molecular FormulaC18H30N8O6S
  • Average mass486.546 Da
  • Monoisotopic mass486.200897 Da
  • ChemSpider ID29787301

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

Glycine, γ-glutamyl-S-[4-(ethylamino)-6-[(1-methylethyl)amino]-1,3,5-triazin-2-yl]-L-cysteinyl- [ACD/Index Name]
γ-Glutamyl-S-[4-(ethylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl]-L-cysteinylglycin [German] [ACD/IUPAC Name]
γ-Glutamyl-S-[4-(ethylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl]-L-cysteinylglycine [ACD/IUPAC Name]
γ-Glutamyl-S-[4-(éthylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl]-L-cystéinylglycine [French] [ACD/IUPAC Name]
24429-05-8 [RN]
Atrazine Glutathione Adduct
Glutathione S-atrazine
L-γ-Glutamyl-S-[4-(ethylamino)-6-[(1-methylethyl)amino]-1,3,5-triazin-2-yl]-L-cysteinylglycine
S-(4-Ethylamino-6-isopropylamino-2-s-triazino)glutathione

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.609
Molar Refractivity: 119.3±0.4 cm3
#H bond acceptors: 14
#H bond donors: 8
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 1.73
ACD/LogD (pH 5.5): -2.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 247 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 80.2±5.0 dyne/cm
Molar Volume: 344.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement