ChemSpider 2D Image | N-Acetyl-N-methylisoleucyl-N-[1-({1-[5-formyl-2-hydroxy-3-(hydroxymethyl)-3,6-dimethyl-2-morpholinyl]-3-methylbutyl}amino)-1,3-dioxo-2-butanyl]isoleucinamide | C32H57N5O9

N-Acetyl-N-methylisoleucyl-N-[1-({1-[5-formyl-2-hydroxy-3-(hydroxymethyl)-3,6-dimethyl-2-morpholinyl]-3-methylbutyl}amino)-1,3-dioxo-2-butanyl]isoleucinamide

  • Molecular FormulaC32H57N5O9
  • Average mass655.823 Da
  • Monoisotopic mass655.415649 Da
  • ChemSpider ID3131

More details:

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

Isoleucinamide, N-acetyl-N-methylisoleucyl-N-[1-[[[1-[5-formyl-2-hydroxy-3-(hydroxymethyl)-3,6-dimethyl-2-morpholinyl]-3-methylbutyl]amino]carbonyl]-2-oxopropyl]- [ACD/Index Name]
N-Acetyl-N-methylisoleucyl-N-[1-({1-[5-formyl-2-hydroxy-3-(hydroxymethyl)-3,6-dimethyl-2-morpholinyl]-3-methylbutyl}amino)-1,3-dioxo-2-butanyl]isoleucinamid [German] [ACD/IUPAC Name]
N-Acetyl-N-methylisoleucyl-N-[1-({1-[5-formyl-2-hydroxy-3-(hydroxymethyl)-3,6-dimethyl-2-morpholinyl]-3-methylbutyl}amino)-1,3-dioxo-2-butanyl]isoleucinamide [ACD/IUPAC Name]
N-Acétyl-N-méthylisoleucyl-N-[1-({1-[5-formyl-2-hydroxy-3-(hydroxyméthyl)-3,6-diméthyl-2-morpholinyl]-3-méthylbutyl}amino)-1,3-dioxo-2-butanyl]isoleucinamide [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: 883.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 145.9±6.0 kJ/mol
Flash Point: 488.1±34.3 °C
Index of Refraction: 1.515
Molar Refractivity: 172.6±0.3 cm3
#H bond acceptors: 14
#H bond donors: 6
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 3
ACD/LogP: 3.81
ACD/LogD (pH 5.5): 1.56
ACD/BCF (pH 5.5): 7.91
ACD/KOC (pH 5.5): 131.13
ACD/LogD (pH 7.4): 1.79
ACD/BCF (pH 7.4): 13.45
ACD/KOC (pH 7.4): 222.95
Polar Surface Area: 203 Å2
Polarizability: 68.4±0.5 10-24cm3
Surface Tension: 45.2±3.0 dyne/cm
Molar Volume: 572.8±3.0 cm3

Click to predict properties on the Chemicalize site


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