ChemSpider 2D Image | N-Undecanoyl-L-Histidyl-L-Phenylalanyl-N-Methyl-N-(2-Pyridin-2-Ylethyl)-L-Tyrosinamide | C43H57N7O5

N-Undecanoyl-L-Histidyl-L-Phenylalanyl-N-Methyl-N-(2-Pyridin-2-Ylethyl)-L-Tyrosinamide

  • Molecular FormulaC43H57N7O5
  • Average mass751.957 Da
  • Monoisotopic mass751.442139 Da
  • ChemSpider ID24666517

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

L-Tyrosinamide, N-(1-oxoundecyl)-L-histidyl-L-phenylalanyl-N-methyl-N-[2-(2-pyridinyl)ethyl]- [ACD/Index Name]
N-Undecanoyl-L-Histidyl-L-Phenylalanyl-N-Methyl-N-(2-Pyridin-2-Ylethyl)-L-Tyrosinamide
N-Undecanoyl-L-histidyl-L-phenylalanyl-N-methyl-N-[2-(2-pyridinyl)ethyl]-L-tyrosinamid [German] [ACD/IUPAC Name]
N-Undecanoyl-L-histidyl-L-phenylalanyl-N-methyl-N-[2-(2-pyridinyl)ethyl]-L-tyrosinamide [ACD/IUPAC Name]
N-Undecanoyl-L-histidyl-L-phénylalanyl-N-méthyl-N-[2-(2-pyridinyl)éthyl]-L-tyrosinamide [French] [ACD/IUPAC Name]
BD8
N-((S)-1-((S)-1-((S)-3-(4-hydroxyphenyl)-1-(methyl(2-(pyridin-2-yl)ethyl)amino)-1-oxopropan-2-ylamino)-1-oxo-3-phenylpropan-2-ylamino)-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl)undecanamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 1066.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 161.7±3.0 kJ/mol
Flash Point: 599.0±34.3 °C
Index of Refraction: 1.585
Molar Refractivity: 213.6±0.3 cm3
#H bond acceptors: 12
#H bond donors: 5
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 4
ACD/LogP: 6.74
ACD/LogD (pH 5.5): 4.72
ACD/BCF (pH 5.5): 1041.40
ACD/KOC (pH 5.5): 1974.30
ACD/LogD (pH 7.4): 6.07
ACD/BCF (pH 7.4): 23170.42
ACD/KOC (pH 7.4): 43926.91
Polar Surface Area: 169 Å2
Polarizability: 84.7±0.5 10-24cm3
Surface Tension: 53.1±3.0 dyne/cm
Molar Volume: 637.5±3.0 cm3

Click to predict properties on the Chemicalize site


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