ChemSpider 2D Image | N-(2-Furylmethyl)-N'-({(2S)-3-[(4-methoxy-3-methylphenyl)sulfonyl]-1,3-oxazinan-2-yl}methyl)ethanediamide | C20H25N3O7S

N-(2-Furylmethyl)-N'-({(2S)-3-[(4-methoxy-3-methylphenyl)sulfonyl]-1,3-oxazinan-2-yl}methyl)ethanediamide

  • Molecular FormulaC20H25N3O7S
  • Average mass451.493 Da
  • Monoisotopic mass451.141327 Da
  • ChemSpider ID62610612

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Ethanediamide, N1-(2-furanylmethyl)-N2-[[(2S)-tetrahydro-3-[(4-methoxy-3-methylphenyl)sulfonyl]-2H-1,3-oxazin-2-yl]methyl]- [ACD/Index Name]
N-(2-Furylmethyl)-N'-({(2S)-3-[(4-methoxy-3-methylphenyl)sulfonyl]-1,3-oxazinan-2-yl}methyl)ethandiamid [German] [ACD/IUPAC Name]
N-(2-Furylmethyl)-N'-({(2S)-3-[(4-methoxy-3-methylphenyl)sulfonyl]-1,3-oxazinan-2-yl}methyl)ethanediamide [ACD/IUPAC Name]
N-(2-Furylméthyl)-N'-({(2S)-3-[(4-méthoxy-3-méthylphényl)sulfonyl]-1,3-oxazinan-2-yl}méthyl)éthanediamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.568
Molar Refractivity: 111.9±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.01
ACD/LogD (pH 5.5): 1.62
ACD/BCF (pH 5.5): 9.94
ACD/KOC (pH 5.5): 180.15
ACD/LogD (pH 7.4): 1.62
ACD/BCF (pH 7.4): 9.94
ACD/KOC (pH 7.4): 180.14
Polar Surface Area: 136 Å2
Polarizability: 44.4±0.5 10-24cm3
Surface Tension: 50.5±3.0 dyne/cm
Molar Volume: 342.1±3.0 cm3

Click to predict properties on the Chemicalize site


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