ChemSpider 2D Image | N~2~-{[(2R)-3-Cyclohexyl-1-oxo-1-{[(1R,2S,4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl]amino}-2-propanyl]carbamoyl}-L-lysine | C26H46N4O4

N2-{[(2R)-3-Cyclohexyl-1-oxo-1-{[(1R,2S,4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl]amino}-2-propanyl]carbamoyl}-L-lysine

  • Molecular FormulaC26H46N4O4
  • Average mass478.668 Da
  • Monoisotopic mass478.351898 Da
  • ChemSpider ID35035999

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(2s)-6-Amino-2-[[(1r)-1-(Cyclohexylmethyl)-2-Oxo-2-[[(2s)-1,7,7-Trimethylnorbornan-2-Yl]amino]ethyl]arbamoylamino]hexanoic Acid
L-Lysine, N2-[[[(1R)-1-(cyclohexylmethyl)-2-oxo-2-[[(1R,2S,4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl]amino]ethyl]amino]carbonyl]- [ACD/Index Name]
N2-{[(2R)-3-Cyclohexyl-1-oxo-1-{[(1R,2S,4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl]amino}-2-propanyl]carbamoyl}-L-lysin [German] [ACD/IUPAC Name]
N2-{[(2R)-3-Cyclohexyl-1-oxo-1-{[(1R,2S,4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl]amino}-2-propanyl]carbamoyl}-L-lysine [ACD/IUPAC Name]
N2-{[(2R)-3-Cyclohexyl-1-oxo-1-{[(1R,2S,4R)-1,7,7-triméthylbicyclo[2.2.1]hept-2-yl]amino}-2-propanyl]carbamoyl}-L-lysine [French] [ACD/IUPAC Name]
GWX

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

Density: 1.2±0.1 g/cm3
Boiling Point: 716.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.0 mmHg at 25°C
Enthalpy of Vaporization: 114.0±6.0 kJ/mol
Flash Point: 386.9±32.9 °C
Index of Refraction: 1.551
Molar Refractivity: 132.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 3.85
ACD/LogD (pH 5.5): 0.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.18
ACD/LogD (pH 7.4): 0.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.20
Polar Surface Area: 134 Å2
Polarizability: 52.6±0.5 10-24cm3
Surface Tension: 51.2±5.0 dyne/cm
Molar Volume: 416.0±5.0 cm3

Click to predict properties on the Chemicalize site


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