ChemSpider 2D Image | Z-Ile-Leu-aldehyde | C20H30N2O4

Z-Ile-Leu-aldehyde

  • Molecular FormulaC20H30N2O4
  • Average mass362.463 Da
  • Monoisotopic mass362.220551 Da
  • ChemSpider ID23222837

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

161710-10-7 [RN]
benzyl N-[(1S,2S)-2-methyl-1-{[(2S)-4-methyl-1-oxopentan-2-yl]carbamoyl}butyl]carbamate
carbamic acid, N-[(1S)-1-[[[(1S)-1-formyl-3-methylbutyl]amino]carbonyl]-2-methylbutyl]-, phenylmethyl ester
Carbamic acid, N-[(1S,2S)-1-[[[(1S)-1-formyl-3-methylbutyl]amino]carbonyl]-2-methylbutyl]-, phenylmethyl ester [ACD/Index Name]
N2-[(Benzyloxy)carbonyl]-N-[(2S)-4-methyl-1-oxo-2-pentanyl]-L-isoleucinamid [German] [ACD/IUPAC Name]
N2-[(Benzyloxy)carbonyl]-N-[(2S)-4-methyl-1-oxo-2-pentanyl]-L-isoleucinamide [ACD/IUPAC Name]
N2-[(Benzyloxy)carbonyl]-N-[(2S)-4-méthyl-1-oxo-2-pentanyl]-L-isoleucinamide [French] [ACD/IUPAC Name]
N2-[(benzyloxy)carbonyl]-N-[(2S)-4-methyl-1-oxopentan-2-yl]-L-isoleucinamide
Z-Ile-Leu-aldehyde
?-Secretase inhibitor XII
More...
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Bio Activity:

      ?-secretase MedChem Express HY-12465
      Neuronal Signaling MedChem Express HY-12465
      Neuronal Signaling; Wnt/Hedgehog/Notch; MedChem Express HY-12465
      Z-Ile-Leu-aldehyde(Z-IL-CHO; GSI-XII) is a potent gamma-Secretase inhibitor; Notch signaling inhibitor. MedChem Express
      Z-Ile-Leu-aldehyde(Z-IL-CHO; GSI-XII) is a potent gamma-Secretase inhibitor; Notch signaling inhibitor.; IC50 value:; Target: gamma-Secretase inhibitor; in vitro: GSI-XII induces apoptosis of murine MOPC315.BM myeloma cells with high Notch activity. MedChem Express HY-12465

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

Density: 1.1±0.1 g/cm3
Boiling Point: 545.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.4±3.0 kJ/mol
Flash Point: 283.7±28.7 °C
Index of Refraction: 1.507
Molar Refractivity: 100.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 4.19
ACD/LogD (pH 5.5): 3.16
ACD/BCF (pH 5.5): 149.79
ACD/KOC (pH 5.5): 1255.47
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 149.73
ACD/KOC (pH 7.4): 1255.04
Polar Surface Area: 85 Å2
Polarizability: 39.8±0.5 10-24cm3
Surface Tension: 39.4±3.0 dyne/cm
Molar Volume: 337.4±3.0 cm3

Click to predict properties on the Chemicalize site


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