ChemSpider 2D Image | 5-(5-Ethyl-1,2,4-oxadiazol-3-yl)-N-{2-[4-(2-furoyl)-1-piperazinyl]-2-oxoethyl}-2-methyl-3-thiophenesulfonamide | C20H23N5O6S2

5-(5-Ethyl-1,2,4-oxadiazol-3-yl)-N-{2-[4-(2-furoyl)-1-piperazinyl]-2-oxoethyl}-2-methyl-3-thiophenesulfonamide

  • Molecular FormulaC20H23N5O6S2
  • Average mass493.556 Da
  • Monoisotopic mass493.108978 Da
  • ChemSpider ID28975840

More details:

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

3-Thiophenesulfonamide, 5-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-[2-[4-(2-furanylcarbonyl)-1-piperazinyl]-2-oxoethyl]-2-methyl- [ACD/Index Name]
5-(5-Ethyl-1,2,4-oxadiazol-3-yl)-N-{2-[4-(2-furoyl)-1-piperazinyl]-2-oxoethyl}-2-methyl-3-thiophenesulfonamide [ACD/IUPAC Name]
5-(5-Éthyl-1,2,4-oxadiazol-3-yl)-N-{2-[4-(2-furoyl)-1-pipérazinyl]-2-oxoéthyl}-2-méthyl-3-thiophènesulfonamide [French] [ACD/IUPAC Name]
5-(5-Ethyl-1,2,4-oxadiazol-3-yl)-N-{2-[4-(2-furoyl)-1-piperazinyl]-2-oxoethyl}-2-methyl-3-thiophensulfonamid [German] [ACD/IUPAC Name]
5-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-{2-[4-(2-furylcarbonyl)piperazino]-2-oxoethyl}-2-methyl-3-thiophenesulfonamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 756.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.2±3.0 kJ/mol
Flash Point: 411.4±35.7 °C
Index of Refraction: 1.604
Molar Refractivity: 119.6±0.4 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 1.65
ACD/LogD (pH 5.5): 1.11
ACD/BCF (pH 5.5): 4.09
ACD/KOC (pH 5.5): 95.41
ACD/LogD (pH 7.4): 1.08
ACD/BCF (pH 7.4): 3.85
ACD/KOC (pH 7.4): 89.65
Polar Surface Area: 175 Å2
Polarizability: 47.4±0.5 10-24cm3
Surface Tension: 61.7±3.0 dyne/cm
Molar Volume: 347.7±3.0 cm3

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