ChemSpider 2D Image | Ethyl 4-({2-(4-chlorophenyl)-4-hydroxy-1-[2-(4-morpholinyl)ethyl]-5-oxo-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate | C26H30ClN3O6

Ethyl 4-({2-(4-chlorophenyl)-4-hydroxy-1-[2-(4-morpholinyl)ethyl]-5-oxo-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate

  • Molecular FormulaC26H30ClN3O6
  • Average mass515.986 Da
  • Monoisotopic mass515.182312 Da
  • ChemSpider ID12224966

More details:

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

1H-Pyrrole-2-carboxylic acid, 4-[[2-(4-chlorophenyl)-2,5-dihydro-4-hydroxy-1-[2-(4-morpholinyl)ethyl]-5-oxo-1H-pyrrol-3-yl]carbonyl]-3,5-dimethyl-, ethyl ester [ACD/Index Name]
4-({2-(4-Chlorophényl)-4-hydroxy-1-[2-(4-morpholinyl)éthyl]-5-oxo-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-3,5-diméthyl-1H-pyrrole-2-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-({2-(4-chlorophenyl)-4-hydroxy-1-[2-(4-morpholinyl)ethyl]-5-oxo-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate [ACD/IUPAC Name]
Ethyl 4-({2-(4-chlorophenyl)-4-hydroxy-1-[2-(morpholin-4-yl)ethyl]-5-oxo-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Ethyl-4-({2-(4-chlorphenyl)-4-hydroxy-1-[2-(4-morpholinyl)ethyl]-5-oxo-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-3,5-dimethyl-1H-pyrrol-2-carboxylat [German] [ACD/IUPAC Name]
4-[2-(4-Chloro-phenyl)-4-hydroxy-1-(2-morpholin-4-yl-ethyl)-5-oxo-2,5-dihydro-1H-pyrrole-3-carbonyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester
623136-80-1 [RN]
ethyl 4-(2-(4-chlorophenyl)-4-hydroxy-1-(2-morpholinoethyl)-5-oxo-2,5-dihydro-1H-pyrrole-3-carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-{[2-(4-chlorophenyl)-4-hydroxy-1-(2-morpholin-4-ylethyl)-5-oxo(3-pyrrolin-3-yl)]carbonyl}-3,5-dimethylpyrrole-2-carboxylate

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

Density: 1.3±0.0 g/cm3
Boiling Point: 747.8±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 114.4±0.0 kJ/mol
Flash Point: 406.1±0.0 °C
Index of Refraction: 1.615
Molar Refractivity: 133.8±0.0 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 3.53
ACD/LogD (pH 5.5): 1.45
ACD/BCF (pH 5.5): 2.36
ACD/KOC (pH 5.5): 16.49
ACD/LogD (pH 7.4): 0.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.65
Polar Surface Area: 112 Å2
Polarizability: 53.0±0.0 10-24cm3
Surface Tension: 57.9±0.0 dyne/cm
Molar Volume: 383.1±0.0 cm3

Click to predict properties on the Chemicalize site


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