ChemSpider 2D Image | Ethyl (2Z)-{(5Z)-3-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]-5-[4-(4-morpholinyl)-3-nitrobenzylidene]-4-oxo-1,3-thiazolidin-2-ylidene}acetate | C26H32N4O7S

Ethyl (2Z)-{(5Z)-3-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]-5-[4-(4-morpholinyl)-3-nitrobenzylidene]-4-oxo-1,3-thiazolidin-2-ylidene}acetate

  • Molecular FormulaC26H32N4O7S
  • Average mass544.620 Da
  • Monoisotopic mass544.199158 Da
  • ChemSpider ID17366544

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-{(5Z)-3-[2-(4-Méthyl-1-pipéridinyl)-2-oxoéthyl]-5-[4-(4-morpholinyl)-3-nitrobenzylidène]-4-oxo-1,3-thiazolidin-2-ylidène}acétate d'éthyle [French] [ACD/IUPAC Name]
Acetic acid, 2-[(5Z)-3-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]-5-[[4-(4-morpholinyl)-3-nitrophenyl]methylene]-4-oxo-2-thiazolidinylidene]-, ethyl ester, (2Z)- [ACD/Index Name]
Ethyl (2Z)-{(5Z)-3-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]-5-[4-(4-morpholinyl)-3-nitrobenzylidene]-4-oxo-1,3-thiazolidin-2-ylidene}acetate [ACD/IUPAC Name]
Ethyl-(2Z)-{(5Z)-3-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]-5-[4-(4-morpholinyl)-3-nitrobenzyliden]-4-oxo-1,3-thiazolidin-2-yliden}acetat [German] [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: 788.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.7±3.0 kJ/mol
Flash Point: 430.6±32.9 °C
Index of Refraction: 1.652
Molar Refractivity: 145.2±0.3 cm3
#H bond acceptors: 11
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 5.84
ACD/LogD (pH 5.5): 3.30
ACD/BCF (pH 5.5): 189.85
ACD/KOC (pH 5.5): 1487.63
ACD/LogD (pH 7.4): 3.30
ACD/BCF (pH 7.4): 189.86
ACD/KOC (pH 7.4): 1487.69
Polar Surface Area: 151 Å2
Polarizability: 57.5±0.5 10-24cm3
Surface Tension: 64.4±3.0 dyne/cm
Molar Volume: 397.2±3.0 cm3

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