ChemSpider 2D Image | Ethyl 4-{[(4-{(E)-[3-(4-ethoxyphenyl)-1-ethyl-5-oxo-2-thioxo-4-imidazolidinylidene]methyl}-2-methoxyphenoxy)acetyl]amino}benzoate | C32H33N3O7S

Ethyl 4-{[(4-{(E)-[3-(4-ethoxyphenyl)-1-ethyl-5-oxo-2-thioxo-4-imidazolidinylidene]methyl}-2-methoxyphenoxy)acetyl]amino}benzoate

  • Molecular FormulaC32H33N3O7S
  • Average mass603.685 Da
  • Monoisotopic mass603.203918 Da
  • ChemSpider ID12531796

  • Double-bond stereo - Double-bond stereo

More details:

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

4-{[2-(4-{(E)-[3-(4-Éthoxyphényl)-1-éthyl-5-oxo-2-thioxo-4-imidazolidinylidène]méthyl}-2-méthoxyphénoxy)acétyl]amino}benzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[[2-[4-[(E)-[3-(4-ethoxyphenyl)-1-ethyl-5-oxo-2-thioxo-4-imidazolidinylidene]methyl]-2-methoxyphenoxy]acetyl]amino]-, ethyl ester [ACD/Index Name]
Ethyl 4-{[(4-{(E)-[3-(4-ethoxyphenyl)-1-ethyl-5-oxo-2-thioxo-4-imidazolidinylidene]methyl}-2-methoxyphenoxy)acetyl]amino}benzoate [ACD/IUPAC Name]
Ethyl-4-{[(4-{(E)-[3-(4-ethoxyphenyl)-1-ethyl-5-oxo-2-thioxo-4-imidazolidinyliden]methyl}-2-methoxyphenoxy)acetyl]amino}benzoat [German] [ACD/IUPAC Name]
4-(2-{4-[3-(4-Ethoxy-phenyl)-1-ethyl-5-oxo-2-thioxo-imidazolidin-4-ylidenemethyl]-2-methoxy-phenoxy}-acetylamino)-benzoic acid ethyl ester
ETHYL 4-[2-(4-{[(4E)-3-(4-ETHOXYPHENYL)-1-ETHYL-5-OXO-2-SULFANYLIDENEIMIDAZOLIDIN-4-YLIDENE]METHYL}-2-METHOXYPHENOXY)ACETAMIDO]BENZOATE
ethyl 4-[2-(4-{[3-(4-ethoxyphenyl)-1-ethyl-5-oxo-2-thioxo(1,3-diazolidin-4-ylidene)]methyl}-2-methoxyphenoxy)acetylamino]benzoate

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: 1.654
Molar Refractivity: 164.5±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: 6.18
ACD/LogD (pH 5.5): 4.63
ACD/BCF (pH 5.5): 1949.75
ACD/KOC (pH 5.5): 7880.67
ACD/LogD (pH 7.4): 4.63
ACD/BCF (pH 7.4): 1949.74
ACD/KOC (pH 7.4): 7880.63
Polar Surface Area: 139 Å2
Polarizability: 65.2±0.5 10-24cm3
Surface Tension: 67.1±5.0 dyne/cm
Molar Volume: 448.6±5.0 cm3

Click to predict properties on the Chemicalize site


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