ChemSpider 2D Image | N-[2-(3,4-Dimethoxyphenyl)ethyl]-N'-[1-(4-phenyl-1-piperazinyl)-1-(2-thienyl)-2-propanyl]ethanediamide | C29H36N4O4S

N-[2-(3,4-Dimethoxyphenyl)ethyl]-N'-[1-(4-phenyl-1-piperazinyl)-1-(2-thienyl)-2-propanyl]ethanediamide

  • Molecular FormulaC29H36N4O4S
  • Average mass536.685 Da
  • Monoisotopic mass536.245728 Da
  • ChemSpider ID20271082

More details:

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

Ethanediamide, N1-[2-(3,4-dimethoxyphenyl)ethyl]-N2-[1-methyl-2-(4-phenyl-1-piperazinyl)-2-(2-thienyl)ethyl]- [ACD/Index Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-N'-[1-(4-phenyl-1-piperazinyl)-1-(2-thienyl)-2-propanyl]ethandiamid [German] [ACD/IUPAC Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-N'-[1-(4-phenyl-1-piperazinyl)-1-(2-thienyl)-2-propanyl]ethanediamide [ACD/IUPAC Name]
N-[2-(3,4-Diméthoxyphényl)éthyl]-N'-[1-(4-phényl-1-pipérazinyl)-1-(2-thiényl)-2-propanyl]éthanediamide [French] [ACD/IUPAC Name]
N1-(3,4-dimethoxyphenethyl)-N2-(1-(4-phenylpiperazin-1-yl)-1-(thiophen-2-yl)propan-2-yl)oxalamide

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: 1.597
Molar Refractivity: 150.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 4.14
ACD/LogD (pH 5.5): 3.03
ACD/BCF (pH 5.5): 84.38
ACD/KOC (pH 5.5): 555.98
ACD/LogD (pH 7.4): 3.63
ACD/BCF (pH 7.4): 335.96
ACD/KOC (pH 7.4): 2213.57
Polar Surface Area: 111 Å2
Polarizability: 59.6±0.5 10-24cm3
Surface Tension: 51.1±3.0 dyne/cm
Molar Volume: 441.3±3.0 cm3

Click to predict properties on the Chemicalize site


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