ChemSpider 2D Image | N-[2-(4-Methoxyphenyl)ethyl]-N'-[(2S)-2-(4-phenyl-1-piperazinyl)-2-(3-pyridinyl)ethyl]ethanediamide | C28H33N5O3

N-[2-(4-Methoxyphenyl)ethyl]-N'-[(2S)-2-(4-phenyl-1-piperazinyl)-2-(3-pyridinyl)ethyl]ethanediamide

  • Molecular FormulaC28H33N5O3
  • Average mass487.593 Da
  • Monoisotopic mass487.258331 Da
  • ChemSpider ID62292070

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Ethanediamide, N1-[2-(4-methoxyphenyl)ethyl]-N2-[(2S)-2-(4-phenyl-1-piperazinyl)-2-(3-pyridinyl)ethyl]- [ACD/Index Name]
N-[2-(4-Methoxyphenyl)ethyl]-N'-[(2S)-2-(4-phenyl-1-piperazinyl)-2-(3-pyridinyl)ethyl]ethandiamid [German] [ACD/IUPAC Name]
N-[2-(4-Methoxyphenyl)ethyl]-N'-[(2S)-2-(4-phenyl-1-piperazinyl)-2-(3-pyridinyl)ethyl]ethanediamide [ACD/IUPAC Name]
N-[2-(4-Méthoxyphényl)éthyl]-N'-[(2S)-2-(4-phényl-1-pipérazinyl)-2-(3-pyridinyl)éthyl]éthanediamide [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.603
Molar Refractivity: 138.9±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.80
ACD/LogD (pH 5.5): 1.98
ACD/BCF (pH 5.5): 12.47
ACD/KOC (pH 5.5): 130.35
ACD/LogD (pH 7.4): 2.70
ACD/BCF (pH 7.4): 66.04
ACD/KOC (pH 7.4): 690.37
Polar Surface Area: 87 Å2
Polarizability: 55.0±0.5 10-24cm3
Surface Tension: 53.7±3.0 dyne/cm
Molar Volume: 404.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement