ChemSpider 2D Image | 1-Benzyl-4-{2-[(2,6-dimethyl-4-morpholinyl)carbonyl]-1-benzofuran-5-yl}-4-hydroxypiperidinium | C27H33N2O4

1-Benzyl-4-{2-[(2,6-dimethyl-4-morpholinyl)carbonyl]-1-benzofuran-5-yl}-4-hydroxypiperidinium

  • Molecular FormulaC27H33N2O4
  • Average mass449.561 Da
  • Monoisotopic mass449.243469 Da
  • ChemSpider ID24810712

  • Charge - Charge

More details:

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

1-Benzyl-4-{2-[(2,6-dimethyl-4-morpholinyl)carbonyl]-1-benzofuran-5-yl}-4-hydroxypiperidinium [ACD/IUPAC Name]
1-Benzyl-4-{2-[(2,6-dimethyl-4-morpholinyl)carbonyl]-1-benzofuran-5-yl}-4-hydroxypiperidinium [German] [ACD/IUPAC Name]
1-Benzyl-4-{2-[(2,6-diméthyl-4-morpholinyl)carbonyl]-1-benzofuran-5-yl}-4-hydroxypipéridinium [French] [ACD/IUPAC Name]
Methanone, (2,6-dimethyl-4-morpholinyl)[5-[4-hydroxy-1-(phenylmethyl)-4-piperidinyl]-2-benzofuranyl]-, conjugate monoacid [ACD/Index Name]
ZINC12218154

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

Density:
Boiling Point: 633.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.4±3.0 kJ/mol
Flash Point: 336.9±31.5 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.98
ACD/LogD (pH 5.5): -0.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.73
ACD/LogD (pH 7.4): 1.39
ACD/BCF (pH 7.4): 5.13
ACD/KOC (pH 7.4): 82.07
Polar Surface Area: 67 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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