Found 4 results

Search term: MF = 'C_{42}H_{64}N_{6}O_{9}'
ChemSpider 2D Image | N-[(Benzyloxy)carbonyl]-D-valyl-L-leucyl-N~6~-[(benzyloxy)carbonyl]-N-methyl-N-[2-(methyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)ethyl]-L-lysinamide | C42H64N6O9

N-[(Benzyloxy)carbonyl]-D-valyl-L-leucyl-N6-[(benzyloxy)carbonyl]-N-methyl-N-[2-(methyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)ethyl]-L-lysinamide

  • Molecular FormulaC42H64N6O9
  • Average mass796.992 Da
  • Monoisotopic mass796.473450 Da
  • ChemSpider ID8923220

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

L-Lysinamide, N-[(phenylmethoxy)carbonyl]-D-valyl-L-leucyl-N-[2-[[(1,1-dimethylethoxy)carbonyl]methylamino]ethyl]-N-methyl-N6-[(phenylmethoxy)carbonyl]- [ACD/Index Name]
N-[(Benzyloxy)carbonyl]-D-valyl-L-leucyl-N6-[(benzyloxy)carbonyl]-N-methyl-N-[2-(methyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)ethyl]-L-lysinamid [German] [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]-D-valyl-L-leucyl-N6-[(benzyloxy)carbonyl]-N-methyl-N-[2-(methyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)ethyl]-L-lysinamide [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]-D-valyl-L-leucyl-N6-[(benzyloxy)carbonyl]-N-méthyl-N-[2-(méthyl{[(2-méthyl-2-propanyl)oxy]carbonyl}amino)éthyl]-L-lysinamide [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 951.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 138.7±3.0 kJ/mol
Flash Point: 529.5±34.3 °C
Index of Refraction: 1.534
Molar Refractivity: 217.0±0.3 cm3
#H bond acceptors: 15
#H bond donors: 4
#Freely Rotating Bonds: 25
#Rule of 5 Violations: 3
ACD/LogP: 7.34
ACD/LogD (pH 5.5): 5.31
ACD/BCF (pH 5.5): 6377.91
ACD/KOC (pH 5.5): 18395.09
ACD/LogD (pH 7.4): 5.31
ACD/BCF (pH 7.4): 6376.49
ACD/KOC (pH 7.4): 18390.99
Polar Surface Area: 185 Å2
Polarizability: 86.0±0.5 10-24cm3
Surface Tension: 44.5±3.0 dyne/cm
Molar Volume: 698.6±3.0 cm3

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