ChemSpider 2D Image | cis-4-{[(2-Methyl-2-propanyl)sulfonyl]amino}-N-[5-(trifluoromethyl)-2-pyridinyl]cyclohexanecarboxamide | C17H24F3N3O3S

cis-4-{[(2-Methyl-2-propanyl)sulfonyl]amino}-N-[5-(trifluoromethyl)-2-pyridinyl]cyclohexanecarboxamide

  • Molecular FormulaC17H24F3N3O3S
  • Average mass407.451 Da
  • Monoisotopic mass407.149048 Da
  • ChemSpider ID114391253

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

cis-4-{[(2-Methyl-2-propanyl)sulfonyl]amino}-N-[5-(trifluormethyl)-2-pyridinyl]cyclohexancarboxamid [German] [ACD/IUPAC Name]
cis-4-{[(2-Methyl-2-propanyl)sulfonyl]amino}-N-[5-(trifluoromethyl)-2-pyridinyl]cyclohexanecarboxamide [ACD/IUPAC Name]
cis-4-{[(2-Méthyl-2-propanyl)sulfonyl]amino}-N-[5-(trifluorométhyl)-2-pyridinyl]cyclohexanecarboxamide [French] [ACD/IUPAC Name]
Cyclohexanecarboxamide, 4-[[(1,1-dimethylethyl)sulfonyl]amino]-N-[5-(trifluoromethyl)-2-pyridinyl]-, cis- [ACD/Index 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: 1.525
Molar Refractivity: 94.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.65
ACD/LogD (pH 5.5): 3.55
ACD/BCF (pH 5.5): 294.53
ACD/KOC (pH 5.5): 2037.03
ACD/LogD (pH 7.4): 3.55
ACD/BCF (pH 7.4): 294.48
ACD/KOC (pH 7.4): 2036.71
Polar Surface Area: 97 Å2
Polarizability: 37.5±0.5 10-24cm3
Surface Tension: 46.4±5.0 dyne/cm
Molar Volume: 308.8±5.0 cm3

Click to predict properties on the Chemicalize site


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