ChemSpider 2D Image | N-Octanoyl-L-tyrosyl-N-[(2S)-4-methyl-1-oxo-2-pentanyl]-L-alpha-glutamine | C28H43N3O7

N-Octanoyl-L-tyrosyl-N-[(2S)-4-methyl-1-oxo-2-pentanyl]-L-α-glutamine

  • Molecular FormulaC28H43N3O7
  • Average mass533.657 Da
  • Monoisotopic mass533.310120 Da
  • ChemSpider ID425526

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

L-α-Glutamine, N-(1-oxooctyl)-L-tyrosyl-N-[(1S)-1-formyl-3-methylbutyl]- [ACD/Index Name]
N-Octanoyl-L-tyrosyl-N-[(2S)-4-methyl-1-oxo-2-pentanyl]-L-α-glutamin [German] [ACD/IUPAC Name]
N-Octanoyl-L-tyrosyl-N-[(2S)-4-methyl-1-oxo-2-pentanyl]-L-α-glutamine [ACD/IUPAC Name]
N-Octanoyl-L-tyrosyl-N-[(2S)-4-méthyl-1-oxo-2-pentanyl]-L-α-glutamine [French] [ACD/IUPAC Name]
Octanoyl-Tyr-Glu-Leu-OH

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

AIDS107034 [DBID]
AIDS-107034 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 865.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 131.8±3.0 kJ/mol
Flash Point: 477.5±34.3 °C
Index of Refraction: 1.530
Molar Refractivity: 142.8±0.3 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 3
ACD/LogP: 4.13
ACD/LogD (pH 5.5): 2.42
ACD/BCF (pH 5.5): 21.56
ACD/KOC (pH 5.5): 146.42
ACD/LogD (pH 7.4): 0.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.34
Polar Surface Area: 162 Å2
Polarizability: 56.6±0.5 10-24cm3
Surface Tension: 47.6±3.0 dyne/cm
Molar Volume: 462.1±3.0 cm3

Click to predict properties on the Chemicalize site


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