ChemSpider 2D Image | 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-[3-ethoxy-4-(3-methylbutoxy)phenyl]-3-hydroxy-4-[(2E)-3-phenyl-2-propenoyl]-1,5-dihydro-2H-pyrrol-2-one | C32H34N2O6S

1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-[3-ethoxy-4-(3-methylbutoxy)phenyl]-3-hydroxy-4-[(2E)-3-phenyl-2-propenoyl]-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC32H34N2O6S
  • Average mass574.687 Da
  • Monoisotopic mass574.213745 Da
  • ChemSpider ID4835964

  • Double-bond stereo - Double-bond stereo

More details:

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

1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-[3-ethoxy-4-(3-methylbutoxy)phenyl]-3-hydroxy-4-[(2E)-3-phenyl-2-propenoyl]-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-[3-ethoxy-4-(3-methylbutoxy)phenyl]-3-hydroxy-4-[(2E)-3-phenyl-2-propenoyl]-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
1-(5-Acétyl-4-méthyl-1,3-thiazol-2-yl)-5-[3-éthoxy-4-(3-méthylbutoxy)phényl]-3-hydroxy-4-[(2E)-3-phényl-2-propenoyl]-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-[3-ethoxy-4-(3-methylbutoxy)phenyl]-3-hydroxy-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one
2H-Pyrrol-2-one, 1-(5-acetyl-4-methyl-2-thiazolyl)-5-[3-ethoxy-4-(3-methylbutoxy)phenyl]-1,5-dihydro-3-hydroxy-4-[(2E)-1-oxo-3-phenyl-2-propen-1-yl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 715.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 109.8±3.0 kJ/mol
Flash Point: 386.5±35.7 °C
Index of Refraction: 1.626
Molar Refractivity: 160.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 6.46
ACD/LogD (pH 5.5): 3.70
ACD/BCF (pH 5.5): 215.19
ACD/KOC (pH 5.5): 823.84
ACD/LogD (pH 7.4): 1.94
ACD/BCF (pH 7.4): 3.71
ACD/KOC (pH 7.4): 14.21
Polar Surface Area: 134 Å2
Polarizability: 63.5±0.5 10-24cm3
Surface Tension: 56.3±3.0 dyne/cm
Molar Volume: 452.4±3.0 cm3

Click to predict properties on the Chemicalize site


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