ChemSpider 2D Image | Ethyl 4-[4-{2-[(4-methoxyphenyl)amino]-2-oxoethyl}-5-oxo-3-(3-pyridinylmethyl)-2-thioxo-1-imidazolidinyl]benzoate | C27H26N4O5S

Ethyl 4-[4-{2-[(4-methoxyphenyl)amino]-2-oxoethyl}-5-oxo-3-(3-pyridinylmethyl)-2-thioxo-1-imidazolidinyl]benzoate

  • Molecular FormulaC27H26N4O5S
  • Average mass518.584 Da
  • Monoisotopic mass518.162415 Da
  • ChemSpider ID3124216

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

4-[4-{2-[(4-Méthoxyphényl)amino]-2-oxoéthyl}-5-oxo-3-(3-pyridinylméthyl)-2-thioxo-1-imidazolidinyl]benzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[4-[2-[(4-methoxyphenyl)amino]-2-oxoethyl]-5-oxo-3-(3-pyridinylmethyl)-2-thioxo-1-imidazolidinyl]-, ethyl ester [ACD/Index Name]
Ethyl 4-[4-{2-[(4-methoxyphenyl)amino]-2-oxoethyl}-5-oxo-3-(3-pyridinylmethyl)-2-thioxo-1-imidazolidinyl]benzoate [ACD/IUPAC Name]
Ethyl-4-[4-{2-[(4-methoxyphenyl)amino]-2-oxoethyl}-5-oxo-3-(3-pyridinylmethyl)-2-thioxo-1-imidazolidinyl]benzoat [German] [ACD/IUPAC Name]
1024020-37-8 [RN]
4-{4-[(4-Methoxy-phenylcarbamoyl)-methyl]-5-oxo-3-pyridin-3-ylmethyl-2-thioxo-imidazolidin-1-yl}-benzoic acid ethyl ester
ethyl 4-(4-(2-((4-methoxyphenyl)amino)-2-oxoethyl)-5-oxo-3-(pyridin-3-ylmethyl)-2-thioxoimidazolidin-1-yl)benzoate
ETHYL 4-(4-{[(4-METHOXYPHENYL)CARBAMOYL]METHYL}-5-OXO-3-(PYRIDIN-3-YLMETHYL)-2-SULFANYLIDENEIMIDAZOLIDIN-1-YL)BENZOATE
ETHYL 4-(4-{[(4-METHOXYPHENYL)CARBAMOYL]METHYL}-5-OXO-3-[(PYRIDIN-3-YL)METHYL]-2-SULFANYLIDENEIMIDAZOLIDIN-1-YL)BENZOATE
ethyl 4-(4-{[N-(4-methoxyphenyl)carbamoyl]methyl}-5-oxo-3-(3-pyridylmethyl)-2-thioxo-1,3-diazolidinyl)benzoate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

A3259/0138543 [DBID]

    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: 1.676
    Molar Refractivity: 140.6±0.4 cm3
    #H bond acceptors: 9
    #H bond donors: 1
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 1
    ACD/LogP: 2.85
    ACD/LogD (pH 5.5): 2.73
    ACD/BCF (pH 5.5): 68.36
    ACD/KOC (pH 5.5): 696.50
    ACD/LogD (pH 7.4): 2.77
    ACD/BCF (pH 7.4): 75.26
    ACD/KOC (pH 7.4): 766.83
    Polar Surface Area: 133 Å2
    Polarizability: 55.7±0.5 10-24cm3
    Surface Tension: 74.0±5.0 dyne/cm
    Molar Volume: 373.8±5.0 cm3

    Click to predict properties on the Chemicalize site


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