ChemSpider 2D Image | N-[(4-Hydroxy-3-iodo-5-nitrophenyl)acetyl]leucyl-N-[(1E)-5-methyl-1-(methylsulfonyl)-1-hexen-3-yl]leucinamide | C28H43IN4O8S

N-[(4-Hydroxy-3-iodo-5-nitrophenyl)acetyl]leucyl-N-[(1E)-5-methyl-1-(methylsulfonyl)-1-hexen-3-yl]leucinamide

  • Molecular FormulaC28H43IN4O8S
  • Average mass722.633 Da
  • Monoisotopic mass722.184631 Da
  • ChemSpider ID13173820

  • Double-bond stereo - Double-bond stereo

More details:

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

Leucinamide, N-[2-(4-hydroxy-3-iodo-5-nitrophenyl)acetyl]leucyl-N-[3-methyl-1-[(E)-2-(methylsulfonyl)ethenyl]butyl]- [ACD/Index Name]
N-[(4-Hydroxy-3-iod-5-nitrophenyl)acetyl]leucyl-N-[(1E)-5-methyl-1-(methylsulfonyl)-1-hexen-3-yl]leucinamid [German] [ACD/IUPAC Name]
N-[(4-Hydroxy-3-iodo-5-nitrophenyl)acetyl]leucyl-N-[(1E)-5-methyl-1-(methylsulfonyl)-1-hexen-3-yl]leucinamide [ACD/IUPAC Name]
N-[2-(4-Hydroxy-3-iodo-5-nitrophényl)acétyl]leucyl-N-[(1E)-5-méthyl-1-(méthylsulfonyl)-1-hexén-3-yl]leucinamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 880.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 132.4±3.0 kJ/mol
Flash Point: 486.5±34.3 °C
Index of Refraction: 1.564
Molar Refractivity: 169.0±0.4 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: 5.36
ACD/LogD (pH 5.5): 3.75
ACD/BCF (pH 5.5): 331.37
ACD/KOC (pH 5.5): 1695.79
ACD/LogD (pH 7.4): 2.10
ACD/BCF (pH 7.4): 7.37
ACD/KOC (pH 7.4): 37.70
Polar Surface Area: 196 Å2
Polarizability: 67.0±0.5 10-24cm3
Surface Tension: 49.7±3.0 dyne/cm
Molar Volume: 519.4±3.0 cm3

Click to predict properties on the Chemicalize site


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