ChemSpider 2D Image | O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-tyrosylglycylglycyl-D-phenylalanyl-L-leucinamide | C40H52N6O8

O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-tyrosylglycylglycyl-D-phenylalanyl-L-leucinamide

  • Molecular FormulaC40H52N6O8
  • Average mass744.876 Da
  • Monoisotopic mass744.384644 Da
  • ChemSpider ID9105900

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

L-Leucinamide, N-[(1,1-dimethylethoxy)carbonyl]-O-(phenylmethyl)-L-tyrosylglycylglycyl-D-phenylalanyl- [ACD/Index Name]
O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-tyrosylglycylglycyl-D-phenylalanyl-L-leucinamid [German] [ACD/IUPAC Name]
O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-tyrosylglycylglycyl-D-phenylalanyl-L-leucinamide [ACD/IUPAC Name]
O-Benzyl-N-{[(2-méthyl-2-propanyl)oxy]carbonyl}-L-tyrosylglycylglycyl-D-phénylalanyl-L-leucinamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 1073.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 157.7±3.0 kJ/mol
Flash Point: 602.9±34.3 °C
Index of Refraction: 1.568
Molar Refractivity: 202.7±0.3 cm3
#H bond acceptors: 14
#H bond donors: 7
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 4
ACD/LogP: 5.12
ACD/LogD (pH 5.5): 4.04
ACD/BCF (pH 5.5): 690.92
ACD/KOC (pH 5.5): 3747.87
ACD/LogD (pH 7.4): 4.04
ACD/BCF (pH 7.4): 690.79
ACD/KOC (pH 7.4): 3747.21
Polar Surface Area: 207 Å2
Polarizability: 80.4±0.5 10-24cm3
Surface Tension: 49.6±3.0 dyne/cm
Molar Volume: 619.7±3.0 cm3

Click to predict properties on the Chemicalize site


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