ChemSpider 2D Image | O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}tyrosyl-N~6~-[(benzyloxy)carbonyl]lysine | C35H43N3O8

O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}tyrosyl-N6-[(benzyloxy)carbonyl]lysine

  • Molecular FormulaC35H43N3O8
  • Average mass633.731 Da
  • Monoisotopic mass633.304993 Da
  • ChemSpider ID338302

More details:

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

Lysine, N-[(1,1-dimethylethoxy)carbonyl]-O-(phenylmethyl)tyrosyl-N6-[(phenylmethoxy)carbonyl]- [ACD/Index Name]
O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}tyrosyl-N6-[(benzyloxy)carbonyl]lysin [German] [ACD/IUPAC Name]
O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}tyrosyl-N6-[(benzyloxy)carbonyl]lysine [ACD/IUPAC Name]
O-Benzyl-N-{[(2-méthyl-2-propanyl)oxy]carbonyl}tyrosyl-N6-[(benzyloxy)carbonyl]lysine [French] [ACD/IUPAC Name]
N6-((Benzyloxy)carbonyl)-N2-(3-(4-(benzyloxy)phenyl)-2-((tert-butoxycarbonyl)amino)propanoyl)lysine

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

AIDS145027 [DBID]
AIDS-145027 [DBID]
NCI60_024005 [DBID]
NSC668876 [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: 866.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 132.0±3.0 kJ/mol
Flash Point: 477.9±34.3 °C
Index of Refraction: 1.570
Molar Refractivity: 172.1±0.3 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 3
ACD/LogP: 6.09
ACD/LogD (pH 5.5): 2.90
ACD/BCF (pH 5.5): 25.88
ACD/KOC (pH 5.5): 77.16
ACD/LogD (pH 7.4): 1.61
ACD/BCF (pH 7.4): 1.33
ACD/KOC (pH 7.4): 3.95
Polar Surface Area: 152 Å2
Polarizability: 68.2±0.5 10-24cm3
Surface Tension: 49.5±3.0 dyne/cm
Molar Volume: 524.7±3.0 cm3

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