ChemSpider 2D Image | O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}tyrosylleucylleucinamide | C33H48N4O6

O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}tyrosylleucylleucinamide

  • Molecular FormulaC33H48N4O6
  • Average mass596.757 Da
  • Monoisotopic mass596.357361 Da
  • ChemSpider ID2362752

More details:

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

Leucinamide, N-[(1,1-dimethylethoxy)carbonyl]-O-(phenylmethyl)tyrosylleucyl- [ACD/Index Name]
O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}tyrosylleucylleucinamid [German] [ACD/IUPAC Name]
O-Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}tyrosylleucylleucinamide [ACD/IUPAC Name]
O-Benzyl-N-{[(2-méthyl-2-propanyl)oxy]carbonyl}tyrosylleucylleucinamide [French] [ACD/IUPAC Name]
tert-butyl 2-{[1-({[1-(aminocarbonyl)-3-methylbutyl]amino}carbonyl)-3-methylbutyl]amino}-1-[4-(benzyloxy)benzyl]-2-oxoethylcarbamate

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

AG-690/11142893 [DBID]
BAS 00470253 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 834.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 121.2±3.0 kJ/mol
Flash Point: 458.2±34.3 °C
Index of Refraction: 1.539
Molar Refractivity: 166.3±0.3 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 4
ACD/LogP: 5.92
ACD/LogD (pH 5.5): 4.30
ACD/BCF (pH 5.5): 1095.90
ACD/KOC (pH 5.5): 5217.54
ACD/LogD (pH 7.4): 4.30
ACD/BCF (pH 7.4): 1095.49
ACD/KOC (pH 7.4): 5215.63
Polar Surface Area: 149 Å2
Polarizability: 65.9±0.5 10-24cm3
Surface Tension: 43.5±3.0 dyne/cm
Molar Volume: 531.0±3.0 cm3

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