ChemSpider 2D Image | N-[(Benzyloxy)carbonyl]-L-norvalyl-N-[(3S)-5-methyl-2-oxohexan-3-yl]leucinamide | C26H41N3O5

N-[(Benzyloxy)carbonyl]-L-norvalyl-N-[(3S)-5-methyl-2-oxohexan-3-yl]leucinamide

  • Molecular FormulaC26H41N3O5
  • Average mass475.621 Da
  • Monoisotopic mass475.304626 Da
  • ChemSpider ID21475072

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

D-Leucinamide, N-[(phenylmethoxy)carbonyl]-L-norvalyl-N-[(1S)-1-acetyl-3-methylbutyl]- [ACD/Index Name]
N-[(Benzyloxy)carbonyl]-L-norvalyl-N-[(3S)-5-methyl-2-oxo-3-hexanyl]-D-leucinamid [German] [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]-L-norvalyl-N-[(3S)-5-methyl-2-oxo-3-hexanyl]-D-leucinamide [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]-L-norvalyl-N-[(3S)-5-méthyl-2-oxo-3-hexanyl]-D-leucinamide [French] [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]-L-norvalyl-N-[(3S)-5-methyl-2-oxohexan-3-yl]leucinamide
[133407-82-6] [RN]
N-[(Phenylmethoxy)carbonyl]-L-leucyl-N-[(1S)-1-formyl-3-methylbutyl]-L-leucinamide
OH2824610
Ponatinib |
Z-Leu-Leu-Leu-CHO
More...

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

MG 132 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Bio Activity:

      Enzymes Tocris Bioscience 1748
      Potent cell-permeable inhibitor of proteasome (IC50 = 100 nM) and calpain (IC50 = 1.2 ?M). Inhibits TNF-?-induced NF-?B activation and I?B? degradation. Induces neurite outgrowth in PC12 cells and has anticancer properties in vitro. Tocris Bioscience 1748
      Potent cell-permeable inhibitor of proteasome (IC50 = 100 nM) and calpain (IC50 = 1.2 ?M). Inhibits TNF-?-induced NF-?B activation and I?B? degradation. Induces neurite outgrowth in PC12 cells and has anticancer properties in vitro. Tocris Bioscience 1748
      Potent cell-permeable inhibitor of proteasome (IC50 = 100 nM) and calpain (IC50 = 1.2 muM). Inhibits TNF-alpha-induced NF-kappaB activation and IkappaBalpha degradation. Induces neurite outgrowth in PC12 cells and has anticancer properties in vitro. Tocris Bioscience 1748
      Proteases Tocris Bioscience 1748
      Proteasome Tocris Bioscience 1748
      Proteasome and calpain inhibitor. Inhibits NF-?B activation Tocris Bioscience 1748
      Proteasome and calpain inhibitor. Inhibits NF-kappaB activation Tocris Bioscience 1748

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

Density: 1.1±0.1 g/cm3
Boiling Point: 689.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.1±3.0 kJ/mol
Flash Point: 370.9±31.5 °C
Index of Refraction: 1.507
Molar Refractivity: 131.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 5.72
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 279.15
ACD/KOC (pH 5.5): 1960.39
ACD/LogD (pH 7.4): 3.52
ACD/BCF (pH 7.4): 279.05
ACD/KOC (pH 7.4): 1959.65
Polar Surface Area: 114 Å2
Polarizability: 52.2±0.5 10-24cm3
Surface Tension: 39.7±3.0 dyne/cm
Molar Volume: 442.5±3.0 cm3

Click to predict properties on the Chemicalize site


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