ChemSpider 2D Image | 5-Amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-2-isopropyl-6-{4-[2-(3-methoxypropoxy)phenyl]-3-oxo-1-piperazinyl}hexanamide | C28H47N5O6

5-Amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-2-isopropyl-6-{4-[2-(3-methoxypropoxy)phenyl]-3-oxo-1-piperazinyl}hexanamide

  • Molecular FormulaC28H47N5O6
  • Average mass549.703 Da
  • Monoisotopic mass549.352661 Da
  • ChemSpider ID28524093

More details:






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

5-Amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-2-isopropyl-6-{4-[2-(3-methoxypropoxy)phenyl]-3-oxo-1-piperazinyl}hexanamid [German] [ACD/IUPAC Name]
5-Amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-2-isopropyl-6-{4-[2-(3-methoxypropoxy)phenyl]-3-oxo-1-piperazinyl}hexanamide [ACD/IUPAC Name]
5-Amino-N-(3-amino-2,2-diméthyl-3-oxopropyl)-4-hydroxy-2-isopropyl-6-{4-[2-(3-méthoxypropoxy)phényl]-3-oxo-1-pipérazinyl}hexanamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 833.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 126.9±3.0 kJ/mol
Flash Point: 457.6±34.3 °C
Index of Refraction: 1.543
Molar Refractivity: 149.5±0.3 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: 0.27
ACD/LogD (pH 5.5): -2.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 160 Å2
Polarizability: 59.3±0.5 10-24cm3
Surface Tension: 49.1±3.0 dyne/cm
Molar Volume: 474.3±3.0 cm3

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