ChemSpider 2D Image | N-(2-Cyclohexylethyl)-N~2~-[(2E)-1,3-dihydroxy-2-{[(Z)-1-hydroxy-2-{4-[4-(2-methyl-1H-imidazol-1-yl)butyl]phenyl}vinyl]imino}propyl]lysinamide | C33H52N6O4

N-(2-Cyclohexylethyl)-N2-[(2E)-1,3-dihydroxy-2-{[(Z)-1-hydroxy-2-{4-[4-(2-methyl-1H-imidazol-1-yl)butyl]phenyl}vinyl]imino}propyl]lysinamide

  • Molecular FormulaC33H52N6O4
  • Average mass596.804 Da
  • Monoisotopic mass596.405029 Da
  • ChemSpider ID95760833

More details:

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

Hexanamide, 6-amino-N-(2-cyclohexylethyl)-2-[[(2E)-1,3-dihydroxy-2-[[(Z)-1-hydroxy-2-[4-[4-(2-methyl-1H-imidazol-1-yl)butyl]phenyl]ethenyl]imino]propyl]amino]- [ACD/Index Name]
N-(2-Cyclohexylethyl)-N2-[(2E)-1,3-dihydroxy-2-{[(Z)-1-hydroxy-2-{4-[4-(2-methyl-1H-imidazol-1-yl)butyl]phenyl}vinyl]imino}propyl]lysinamid [German] [ACD/IUPAC Name]
N-(2-Cyclohexylethyl)-N2-[(2E)-1,3-dihydroxy-2-{[(Z)-1-hydroxy-2-{4-[4-(2-methyl-1H-imidazol-1-yl)butyl]phenyl}vinyl]imino}propyl]lysinamide [ACD/IUPAC Name]
N-(2-Cyclohexyléthyl)-N2-[(2E)-1,3-dihydroxy-2-{[(Z)-1-hydroxy-2-{4-[4-(2-méthyl-1H-imidazol-1-yl)butyl]phényl}vinyl]imino}propyl]lysinamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 844.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 128.6±3.0 kJ/mol
Flash Point: 464.4±34.3 °C
Index of Refraction: 1.600
Molar Refractivity: 168.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 4
ACD/LogP: 7.27
ACD/LogD (pH 5.5): -0.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.55
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.50
Polar Surface Area: 158 Å2
Polarizability: 66.7±0.5 10-24cm3
Surface Tension: 48.7±7.0 dyne/cm
Molar Volume: 491.9±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement