ChemSpider 2D Image | Methyl 3-{[4-(2,4-dioxo-1,3-thiazolidin-3-yl)-1-piperidinyl]sulfonyl}-2-thiophenecarboxylate | C14H16N2O6S3

Methyl 3-{[4-(2,4-dioxo-1,3-thiazolidin-3-yl)-1-piperidinyl]sulfonyl}-2-thiophenecarboxylate

  • Molecular FormulaC14H16N2O6S3
  • Average mass404.482 Da
  • Monoisotopic mass404.017059 Da
  • ChemSpider ID58388685

More details:

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

2-Thiophenecarboxylic acid, 3-[[4-(2,4-dioxo-3-thiazolidinyl)-1-piperidinyl]sulfonyl]-, methyl ester [ACD/Index Name]
3-{[4-(2,4-Dioxo-1,3-thiazolidin-3-yl)-1-pipéridinyl]sulfonyl}-2-thiophènecarboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 3-{[4-(2,4-dioxo-1,3-thiazolidin-3-yl)-1-piperidinyl]sulfonyl}-2-thiophenecarboxylate [ACD/IUPAC Name]
Methyl-3-{[4-(2,4-dioxo-1,3-thiazolidin-3-yl)-1-piperidinyl]sulfonyl}-2-thiophencarboxylat [German] [ACD/IUPAC Name]
methyl 3-((4-(2,4-dioxothiazolidin-3-yl)piperidin-1-yl)sulfonyl)thiophene-2-carboxylate

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

Density: 1.6±0.1 g/cm3
Boiling Point: 596.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.8±3.0 kJ/mol
Flash Point: 314.4±32.9 °C
Index of Refraction: 1.647
Molar Refractivity: 93.8±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.59
ACD/LogD (pH 5.5): 1.14
ACD/BCF (pH 5.5): 4.35
ACD/KOC (pH 5.5): 99.74
ACD/LogD (pH 7.4): 1.14
ACD/BCF (pH 7.4): 4.35
ACD/KOC (pH 7.4): 99.74
Polar Surface Area: 163 Å2
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 70.2±3.0 dyne/cm
Molar Volume: 258.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement