ChemSpider 2D Image | 2-Chloro-5-{5-[(Z)-{(2E)-3-isobutyl-2-[(4-methoxyphenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl]-2-furyl}benzoic acid | C26H23ClN2O5S

2-Chloro-5-{5-[(Z)-{(2E)-3-isobutyl-2-[(4-methoxyphenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl]-2-furyl}benzoic acid

  • Molecular FormulaC26H23ClN2O5S
  • Average mass510.989 Da
  • Monoisotopic mass510.101624 Da
  • ChemSpider ID1416513

  • Double-bond stereo - Double-bond stereo

More details:

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

2-Chlor-5-{5-[(Z)-{(2E)-3-isobutyl-2-[(4-methoxyphenyl)imino]-4-oxo-1,3-thiazolidin-5-yliden}methyl]-2-furyl}benzoesäure [German] [ACD/IUPAC Name]
2-Chloro-5-{5-[(Z)-{(2E)-3-isobutyl-2-[(4-methoxyphenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl]-2-furyl}benzoic acid [ACD/IUPAC Name]
Acide 2-chloro-5-{5-[(Z)-{(2E)-3-isobutyl-2-[(4-méthoxyphényl)imino]-4-oxo-1,3-thiazolidin-5-ylidène}méthyl]-2-furyl}benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-chloro-5-[5-[(Z)-[(2E)-2-[(4-methoxyphenyl)imino]-3-(2-methylpropyl)-4-oxo-5-thiazolidinylidene]methyl]-2-furanyl]- [ACD/Index Name]
2-chloro-5-(5-((Z)-((E)-3-isobutyl-2-((4-methoxyphenyl)imino)-4-oxothiazolidin-5-ylidene)methyl)furan-2-yl)benzoic acid
2-chloro-5-(5-{(Z)-[(2E)-2-[(4-methoxyphenyl)imino]-3-(2-methylpropyl)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid
2-Chloro-5-{5-[3-isobutyl-2-(4-methoxy-phenylimino)-4-oxo-thiazolidin-5-ylidenemethyl]-furan-2-yl}-benzoic acid
443875-14-7 [RN]
VJUSJIYTGAZNME-SNSUMWEISA-N

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

AO-081/15569296 [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: 682.4±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 105.1±3.0 kJ/mol
    Flash Point: 366.5±34.3 °C
    Index of Refraction: 1.641
    Molar Refractivity: 136.4±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 2
    ACD/LogP: 7.06
    ACD/LogD (pH 5.5): 3.19
    ACD/BCF (pH 5.5): 36.97
    ACD/KOC (pH 5.5): 83.04
    ACD/LogD (pH 7.4): 2.68
    ACD/BCF (pH 7.4): 11.24
    ACD/KOC (pH 7.4): 25.25
    Polar Surface Area: 118 Å2
    Polarizability: 54.1±0.5 10-24cm3
    Surface Tension: 49.7±7.0 dyne/cm
    Molar Volume: 378.1±7.0 cm3

    Click to predict properties on the Chemicalize site


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