ChemSpider 2D Image | (2Z,5Z)-5-(3-Bromo-4-hydroxy-5-methoxybenzylidene)-3-(2-methylphenyl)-2-[(2-methylphenyl)imino]-1,3-thiazolidin-4-one | C25H21BrN2O3S

(2Z,5Z)-5-(3-Bromo-4-hydroxy-5-methoxybenzylidene)-3-(2-methylphenyl)-2-[(2-methylphenyl)imino]-1,3-thiazolidin-4-one

  • Molecular FormulaC25H21BrN2O3S
  • Average mass509.415 Da
  • Monoisotopic mass508.045624 Da
  • ChemSpider ID7791248

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z,5Z)-5-(3-Brom-4-hydroxy-5-methoxybenzyliden)-3-(2-methylphenyl)-2-[(2-methylphenyl)imino]-1,3-thiazolidin-4-on [German] [ACD/IUPAC Name]
(2Z,5Z)-5-(3-Bromo-4-hydroxy-5-methoxybenzylidene)-3-(2-methylphenyl)-2-[(2-methylphenyl)imino]-1,3-thiazolidin-4-one [ACD/IUPAC Name]
(2Z,5Z)-5-(3-Bromo-4-hydroxy-5-méthoxybenzylidène)-3-(2-méthylphényl)-2-[(2-méthylphényl)imino]-1,3-thiazolidin-4-one [French] [ACD/IUPAC Name]
4-Thiazolidinone, 5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylene]-3-(2-methylphenyl)-2-[(2-methylphenyl)imino]-, (2Z,5Z)- [ACD/Index Name]
(2Z,5Z)-5-(3-bromo-4-hydroxy-5-methoxybenzylidene)-3-(o-tolyl)-2-(o-tolylimino)thiazolidin-4-one
362609-34-5 [RN]
5-(3-Bromo-4-hydroxy-5-methoxy-benzylidene)-3-o-tolyl-2-o-tolylimino-thiazolidin-4-one
AKOS000362293
MolPort-002-819-358
MolPort-019-790-556
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AK-968/11840102 [DBID]
ZINC08396127 [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: 614.1±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 94.5±3.0 kJ/mol
    Flash Point: 325.2±34.3 °C
    Index of Refraction: 1.654
    Molar Refractivity: 132.5±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 2
    ACD/LogP: 7.51
    ACD/LogD (pH 5.5): 5.93
    ACD/BCF (pH 5.5): 18671.79
    ACD/KOC (pH 5.5): 39512.98
    ACD/LogD (pH 7.4): 5.55
    ACD/BCF (pH 7.4): 7911.78
    ACD/KOC (pH 7.4): 16742.81
    Polar Surface Area: 87 Å2
    Polarizability: 52.5±0.5 10-24cm3
    Surface Tension: 48.7±7.0 dyne/cm
    Molar Volume: 361.7±7.0 cm3

    Click to predict properties on the Chemicalize site


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