Found 23 results

Search term: MF = 'C_{21}H_{24}N_{2}O_{9}S_{2}'
ChemSpider 2D Image | N'-[(2R)-2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(2-furyl)ethyl]-N-[(3S)-1,1-dioxidotetrahydro-3-thiophenyl]-N-methylethanediamide | C21H24N2O9S2

N'-[(2R)-2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(2-furyl)ethyl]-N-[(3S)-1,1-dioxidotetrahydro-3-thiophenyl]-N-methylethanediamide

  • Molecular FormulaC21H24N2O9S2
  • Average mass512.553 Da
  • Monoisotopic mass512.092346 Da
  • ChemSpider ID62474353

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Ethanediamide, N2-[(2R)-2-[(2,3-dihydro-1,4-benzodioxin-6-yl)sulfonyl]-2-(2-furanyl)ethyl]-N1-methyl-N1-[(3S)-tetrahydro-1,1-dioxido-3-thienyl]- [ACD/Index Name]
N'-[(2R)-2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(2-furyl)ethyl]-N-[(3S)-1,1-dioxidotetrahydro-3-thiophenyl]-N-methylethandiamid [German] [ACD/IUPAC Name]
N'-[(2R)-2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(2-furyl)ethyl]-N-[(3S)-1,1-dioxidotetrahydro-3-thiophenyl]-N-methylethanediamide [ACD/IUPAC Name]
N'-[(2R)-2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(2-furyl)éthyl]-N-[(3S)-1,1-dioxydotétrahydro-3-thiophényl]-N-méthyléthanediamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.638
Molar Refractivity: 119.6±0.4 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -0.32
ACD/LogD (pH 5.5): -0.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 19.11
ACD/LogD (pH 7.4): -0.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 19.11
Polar Surface Area: 166 Å2
Polarizability: 47.4±0.5 10-24cm3
Surface Tension: 72.8±5.0 dyne/cm
Molar Volume: 332.7±5.0 cm3

Click to predict properties on the Chemicalize site


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