ChemSpider 2D Image | 7-{2-(4-Fluorophenyl)-5-isopropyl-4-[(2-oxidophenyl)carbamoyl]-3-phenyl-1H-pyrrol-1-yl}-3,5-dihydroxyheptanoate | C33H33FN2O6

7-{2-(4-Fluorophenyl)-5-isopropyl-4-[(2-oxidophenyl)carbamoyl]-3-phenyl-1H-pyrrol-1-yl}-3,5-dihydroxyheptanoate

  • Molecular FormulaC33H33FN2O6
  • Average mass572.624 Da
  • Monoisotopic mass572.233337 Da
  • ChemSpider ID95777654

  • Charge - Charge

More details:

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

1H-Pyrrole-1-heptanoic acid, 2-(4-fluorophenyl)-β,δ-dihydroxy-4-[[(2-hydroxyphenyl)amino]carbonyl]-5-(1-methylethyl)-3-phenyl-, ion(2-) [ACD/Index Name]
7-{2-(4-Fluorophenyl)-5-isopropyl-4-[(2-oxidophenyl)carbamoyl]-3-phenyl-1H-pyrrol-1-yl}-3,5-dihydroxyheptanoate [ACD/IUPAC Name]
7-{2-(4-Fluorophényl)-5-isopropyl-4-[(2-oxydophényl)carbamoyl]-3-phényl-1H-pyrrol-1-yl}-3,5-dihydroxyheptanoate [French] [ACD/IUPAC Name]
7-{2-(4-Fluorphenyl)-5-isopropyl-4-[(2-oxidophenyl)carbamoyl]-3-phenyl-1H-pyrrol-1-yl}-3,5-dihydroxyheptanoat [German] [ACD/IUPAC Name]

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

Density:
Boiling Point: 741.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.6±3.0 kJ/mol
Flash Point: 402.5±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 4.13
ACD/LogD (pH 5.5): 2.83
ACD/BCF (pH 5.5): 39.71
ACD/KOC (pH 5.5): 202.80
ACD/LogD (pH 7.4): 1.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.41
Polar Surface Area: 138 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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