ChemSpider 2D Image | [1-(3-Methoxyphenyl)-5-(4-methoxyphenyl)-2-methyl-1H-pyrrol-3-yl]{4-[(4-methoxyphenyl)sulfonyl]-1-piperazinyl}methanone | C31H33N3O6S

[1-(3-Methoxyphenyl)-5-(4-methoxyphenyl)-2-methyl-1H-pyrrol-3-yl]{4-[(4-methoxyphenyl)sulfonyl]-1-piperazinyl}methanone

  • Molecular FormulaC31H33N3O6S
  • Average mass575.675 Da
  • Monoisotopic mass575.208984 Da
  • ChemSpider ID2832210

More details:

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

[1-(3-Methoxyphenyl)-5-(4-methoxyphenyl)-2-methyl-1H-pyrrol-3-yl]{4-[(4-methoxyphenyl)sulfonyl]-1-piperazinyl}methanon [German] [ACD/IUPAC Name]
[1-(3-Methoxyphenyl)-5-(4-methoxyphenyl)-2-methyl-1H-pyrrol-3-yl]{4-[(4-methoxyphenyl)sulfonyl]-1-piperazinyl}methanone [ACD/IUPAC Name]
[1-(3-Méthoxyphényl)-5-(4-méthoxyphényl)-2-méthyl-1H-pyrrol-3-yl]{4-[(4-méthoxyphényl)sulfonyl]-1-pipérazinyl}méthanone [French] [ACD/IUPAC Name]
Methanone, [1-(3-methoxyphenyl)-5-(4-methoxyphenyl)-2-methyl-1H-pyrrol-3-yl][4-[(4-methoxyphenyl)sulfonyl]-1-piperazinyl]- [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: 781.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.6±3.0 kJ/mol
Flash Point: 426.1±35.7 °C
Index of Refraction: 1.615
Molar Refractivity: 158.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.09
ACD/LogD (pH 5.5): 4.81
ACD/BCF (pH 5.5): 2651.86
ACD/KOC (pH 5.5): 9821.39
ACD/LogD (pH 7.4): 4.81
ACD/BCF (pH 7.4): 2651.86
ACD/KOC (pH 7.4): 9821.39
Polar Surface Area: 99 Å2
Polarizability: 62.9±0.5 10-24cm3
Surface Tension: 47.8±7.0 dyne/cm
Molar Volume: 454.1±7.0 cm3

Click to predict properties on the Chemicalize site


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