Found 23 results

Search term: MF = 'C_{26}H_{22}BrClN_{2}O_{5}S'
ChemSpider 2D Image | Ethyl (5Z)-5-{[5-bromo-1-(2-ethoxy-2-oxoethyl)-1H-indol-3-yl]methylene}-2-[(4-chlorophenyl)amino]-4-oxo-4,5-dihydro-3-thiophenecarboxylate | C26H22BrClN2O5S

Ethyl (5Z)-5-{[5-bromo-1-(2-ethoxy-2-oxoethyl)-1H-indol-3-yl]methylene}-2-[(4-chlorophenyl)amino]-4-oxo-4,5-dihydro-3-thiophenecarboxylate

  • Molecular FormulaC26H22BrClN2O5S
  • Average mass589.885 Da
  • Monoisotopic mass588.012146 Da
  • ChemSpider ID79644183

  • Double-bond stereo - Double-bond stereo

More details:

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

(5Z)-5-{[5-Bromo-1-(2-éthoxy-2-oxoéthyl)-1H-indol-3-yl]méthylène}-2-[(4-chlorophényl)amino]-4-oxo-4,5-dihydro-3-thiophènecarboxylate d'éthyle [French] [ACD/IUPAC Name]
1H-Indole-1-acetic acid, 5-bromo-3-[(Z)-[5-[(4-chlorophenyl)amino]-4-(ethoxycarbonyl)-3-oxo-2(3H)-thienylidene]methyl]-, ethyl ester [ACD/Index Name]
Ethyl (5Z)-5-{[5-bromo-1-(2-ethoxy-2-oxoethyl)-1H-indol-3-yl]methylene}-2-[(4-chlorophenyl)amino]-4-oxo-4,5-dihydro-3-thiophenecarboxylate [ACD/IUPAC Name]
Ethyl-(5Z)-5-{[5-brom-1-(2-ethoxy-2-oxoethyl)-1H-indol-3-yl]methylen}-2-[(4-chlorphenyl)amino]-4-oxo-4,5-dihydro-3-thiophencarboxylat [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 724.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.8±3.0 kJ/mol
Flash Point: 391.8±32.9 °C
Index of Refraction: 1.658
Molar Refractivity: 144.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 7.40
ACD/LogD (pH 5.5): 6.06
ACD/BCF (pH 5.5): 23928.60
ACD/KOC (pH 5.5): 47425.77
ACD/LogD (pH 7.4): 6.06
ACD/BCF (pH 7.4): 23928.60
ACD/KOC (pH 7.4): 47425.77
Polar Surface Area: 112 Å2
Polarizability: 57.1±0.5 10-24cm3
Surface Tension: 52.8±7.0 dyne/cm
Molar Volume: 391.5±7.0 cm3

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