ChemSpider 2D Image | N-{[1-(2-Fluorobenzoyl)-4-piperidinyl]methyl}-N'-[1-(2-thienylsulfonyl)-1,2,3,4-tetrahydro-7-quinolinyl]ethanediamide | C28H29FN4O5S2

N-{[1-(2-Fluorobenzoyl)-4-piperidinyl]methyl}-N'-[1-(2-thienylsulfonyl)-1,2,3,4-tetrahydro-7-quinolinyl]ethanediamide

  • Molecular FormulaC28H29FN4O5S2
  • Average mass584.682 Da
  • Monoisotopic mass584.156311 Da
  • ChemSpider ID39331345

More details:

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

Ethanediamide, N1-[[1-(2-fluorobenzoyl)-4-piperidinyl]methyl]-N2-[1,2,3,4-tetrahydro-1-(2-thienylsulfonyl)-7-quinolinyl]- [ACD/Index Name]
N-{[1-(2-Fluorbenzoyl)-4-piperidinyl]methyl}-N'-[1-(2-thienylsulfonyl)-1,2,3,4-tetrahydro-7-chinolinyl]ethandiamid [German] [ACD/IUPAC Name]
N-{[1-(2-Fluorobenzoyl)-4-pipéridinyl]méthyl}-N'-[1-(2-thiénylsulfonyl)-1,2,3,4-tétrahydro-7-quinoléinyl]éthanediamide [French] [ACD/IUPAC Name]
N-{[1-(2-Fluorobenzoyl)-4-piperidinyl]methyl}-N'-[1-(2-thienylsulfonyl)-1,2,3,4-tetrahydro-7-quinolinyl]ethanediamide [ACD/IUPAC Name]
N1-((1-(2-fluorobenzoyl)piperidin-4-yl)methyl)-N2-(1-(thiophen-2-ylsulfonyl)-1,2,3,4-tetrahydroquinolin-7-yl)oxalamide

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.644
Molar Refractivity: 150.1±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 1.15
ACD/LogD (pH 5.5): 2.64
ACD/BCF (pH 5.5): 59.66
ACD/KOC (pH 5.5): 649.61
ACD/LogD (pH 7.4): 2.64
ACD/BCF (pH 7.4): 59.64
ACD/KOC (pH 7.4): 649.34
Polar Surface Area: 153 Å2
Polarizability: 59.5±0.5 10-24cm3
Surface Tension: 62.3±3.0 dyne/cm
Molar Volume: 414.4±3.0 cm3

Click to predict properties on the Chemicalize site


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