ChemSpider 2D Image | 3-(4-Thiomorpholinylsulfonyl)-N-(2,6,6-trimethyl-4,5,6,7-tetrahydro-1-benzofuran-4-yl)-2-thiophenecarboxamide | C20H26N2O4S3

3-(4-Thiomorpholinylsulfonyl)-N-(2,6,6-trimethyl-4,5,6,7-tetrahydro-1-benzofuran-4-yl)-2-thiophenecarboxamide

  • Molecular FormulaC20H26N2O4S3
  • Average mass454.626 Da
  • Monoisotopic mass454.105469 Da
  • ChemSpider ID70515458

More details:

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

2-Thiophenecarboxamide, N-(4,5,6,7-tetrahydro-2,6,6-trimethyl-4-benzofuranyl)-3-(4-thiomorpholinylsulfonyl)- [ACD/Index Name]
3-(4-Thiomorpholinylsulfonyl)-N-(2,6,6-trimethyl-4,5,6,7-tetrahydro-1-benzofuran-4-yl)-2-thiophencarboxamid [German] [ACD/IUPAC Name]
3-(4-Thiomorpholinylsulfonyl)-N-(2,6,6-trimethyl-4,5,6,7-tetrahydro-1-benzofuran-4-yl)-2-thiophenecarboxamide [ACD/IUPAC Name]
3-(4-Thiomorpholinylsulfonyl)-N-(2,6,6-triméthyl-4,5,6,7-tétrahydro-1-benzofuran-4-yl)-2-thiophènecarboxamide [French] [ACD/IUPAC Name]

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: 1.648
Molar Refractivity: 118.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.84
ACD/LogD (pH 5.5): 3.57
ACD/BCF (pH 5.5): 305.46
ACD/KOC (pH 5.5): 2090.94
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 305.46
ACD/KOC (pH 7.4): 2090.93
Polar Surface Area: 142 Å2
Polarizability: 46.8±0.5 10-24cm3
Surface Tension: 64.6±5.0 dyne/cm
Molar Volume: 324.5±5.0 cm3

Click to predict properties on the Chemicalize site


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