ChemSpider 2D Image | Ethyl 4-[(Z)-(5-{2-[(4-ethoxyphenyl)amino]-2-oxoethyl}-3-[2-(4-methoxyphenyl)ethyl]-4-oxo-1,3-thiazolidin-2-ylidene)amino]benzoate | C31H33N3O6S

Ethyl 4-[(Z)-(5-{2-[(4-ethoxyphenyl)amino]-2-oxoethyl}-3-[2-(4-methoxyphenyl)ethyl]-4-oxo-1,3-thiazolidin-2-ylidene)amino]benzoate

  • Molecular FormulaC31H33N3O6S
  • Average mass575.675 Da
  • Monoisotopic mass575.208984 Da
  • ChemSpider ID2579003

  • Double-bond stereo - Double-bond stereo

More details:

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

4-[(Z)-(5-{2-[(4-Éthoxyphényl)amino]-2-oxoéthyl}-3-[2-(4-méthoxyphényl)éthyl]-4-oxo-1,3-thiazolidin-2-ylidène)amino]benzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[[(2Z)-5-[2-[(4-ethoxyphenyl)amino]-2-oxoethyl]-3-[2-(4-methoxyphenyl)ethyl]-4-oxo-2-thiazolidinylidene]amino]-, ethyl ester [ACD/Index Name]
ethyl 4-({(2Z)-5-{2-[(4-ethoxyphenyl)amino]-2-oxoethyl}-3-[2-(4-methoxyphenyl)ethyl]-4-oxo-1,3-thiazolidin-2-ylidene}amino)benzoate
Ethyl 4-[(Z)-(5-{2-[(4-ethoxyphenyl)amino]-2-oxoethyl}-3-[2-(4-methoxyphenyl)ethyl]-4-oxo-1,3-thiazolidin-2-ylidene)amino]benzoate [ACD/IUPAC Name]
Ethyl-4-[(Z)-(5-{2-[(4-ethoxyphenyl)amino]-2-oxoethyl}-3-[2-(4-methoxyphenyl)ethyl]-4-oxo-1,3-thiazolidin-2-yliden)amino]benzoat [German] [ACD/IUPAC 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: 1.609
Molar Refractivity: 159.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 6.33
ACD/LogD (pH 5.5): 5.26
ACD/BCF (pH 5.5): 5908.98
ACD/KOC (pH 5.5): 17427.39
ACD/LogD (pH 7.4): 5.26
ACD/BCF (pH 7.4): 5909.36
ACD/KOC (pH 7.4): 17428.50
Polar Surface Area: 132 Å2
Polarizability: 63.1±0.5 10-24cm3
Surface Tension: 47.4±7.0 dyne/cm
Molar Volume: 460.1±7.0 cm3

Click to predict properties on the Chemicalize site


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