ChemSpider 2D Image | trans-N-(1,1-Dioxido-2,3-dihydro-3-thiophenyl)-4-({[(4-methoxyphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide | C19H26N2O6S2

trans-N-(1,1-Dioxido-2,3-dihydro-3-thiophenyl)-4-({[(4-methoxyphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide

  • Molecular FormulaC19H26N2O6S2
  • Average mass442.549 Da
  • Monoisotopic mass442.123230 Da
  • ChemSpider ID21757420

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

Cyclohexanecarboxamide, N-(2,3-dihydro-1,1-dioxido-3-thienyl)-4-[[[(4-methoxyphenyl)sulfonyl]amino]methyl]-, trans- [ACD/Index Name]
trans-N-(1,1-Dioxido-2,3-dihydro-3-thiophenyl)-4-({[(4-methoxyphenyl)sulfonyl]amino}methyl)cyclohexancarboxamid [German] [ACD/IUPAC Name]
trans-N-(1,1-Dioxido-2,3-dihydro-3-thiophenyl)-4-({[(4-methoxyphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide [ACD/IUPAC Name]
trans-N-(1,1-Dioxydo-2,3-dihydro-3-thiophényl)-4-({[(4-méthoxyphényl)sulfonyl]amino}méthyl)cyclohexanecarboxamide [French] [ACD/IUPAC Name]
1212459-77-2 [RN]
4-[(4-Methoxy-benzenesulfonylamino)-methyl]-cyclohexanecarboxylic acid (1,1-dioxo-2,3-dihydro-1H-1λ*6*-thiophen-3-yl)-amide
AGN-PC-01KO5V
AKOS005561959
MCULE-1724088499
MolPort-005-918-411
More...

    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: 1.608
    Molar Refractivity: 109.5±0.4 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 0.87
    ACD/LogD (pH 5.5): 1.12
    ACD/BCF (pH 5.5): 4.15
    ACD/KOC (pH 5.5): 96.32
    ACD/LogD (pH 7.4): 1.12
    ACD/BCF (pH 7.4): 4.15
    ACD/KOC (pH 7.4): 96.32
    Polar Surface Area: 135 Å2
    Polarizability: 43.4±0.5 10-24cm3
    Surface Tension: 61.4±5.0 dyne/cm
    Molar Volume: 316.7±5.0 cm3

    Click to predict properties on the Chemicalize site


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