ChemSpider 2D Image | 2-(3,4-Dimethoxyphenoxy)ethyl 1-[(2-oxo-2,3-dihydro-1,3-benzothiazol-6-yl)sulfonyl]-2-piperidinecarboxylate | C23H26N2O8S2

2-(3,4-Dimethoxyphenoxy)ethyl 1-[(2-oxo-2,3-dihydro-1,3-benzothiazol-6-yl)sulfonyl]-2-piperidinecarboxylate

  • Molecular FormulaC23H26N2O8S2
  • Average mass522.591 Da
  • Monoisotopic mass522.113037 Da
  • ChemSpider ID29404606

More details:

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

1-[(2-Oxo-2,3-dihydro-1,3-benzothiazol-6-yl)sulfonyl]-2-pipéridinecarboxylate de 2-(3,4-diméthoxyphénoxy)éthyle [French] [ACD/IUPAC Name]
2-(3,4-Dimethoxyphenoxy)ethyl 1-[(2-oxo-2,3-dihydro-1,3-benzothiazol-6-yl)sulfonyl]-2-piperidinecarboxylate [ACD/IUPAC Name]
2-(3,4-Dimethoxyphenoxy)ethyl-1-[(2-oxo-2,3-dihydro-1,3-benzothiazol-6-yl)sulfonyl]-2-piperidincarboxylat [German] [ACD/IUPAC Name]
2-Piperidinecarboxylic acid, 1-[(2,3-dihydro-2-oxo-6-benzothiazolyl)sulfonyl]-, 2-(3,4-dimethoxyphenoxy)ethyl ester [ACD/Index 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: 1.606
Molar Refractivity: 129.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 2.71
ACD/LogD (pH 5.5): 2.80
ACD/BCF (pH 5.5): 78.72
ACD/KOC (pH 5.5): 792.18
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 78.09
ACD/KOC (pH 7.4): 785.83
Polar Surface Area: 154 Å2
Polarizability: 51.5±0.5 10-24cm3
Surface Tension: 55.7±3.0 dyne/cm
Molar Volume: 376.4±3.0 cm3

Click to predict properties on the Chemicalize site


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