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Search term: OZGXGUVYEQUNLL (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1-(6-Hydroxy-6-[(4-methylphenoxy)methyl]-4-{4-[2-(4-morpholinyl)ethoxy]benzyl}-1,4-diazepan-1-yl)-2-methoxyethanone | C29H41N3O6

1-(6-Hydroxy-6-[(4-methylphenoxy)methyl]-4-{4-[2-(4-morpholinyl)ethoxy]benzyl}-1,4-diazepan-1-yl)-2-methoxyethanone

  • Molecular FormulaC29H41N3O6
  • Average mass527.652 Da
  • Monoisotopic mass527.299561 Da
  • ChemSpider ID68719793

More details:

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

1-(6-Hydroxy-6-[(4-methylphenoxy)methyl]-4-{4-[2-(4-morpholinyl)ethoxy]benzyl}-1,4-diazepan-1-yl)-2-methoxyethanon [German] [ACD/IUPAC Name]
1-(6-Hydroxy-6-[(4-methylphenoxy)methyl]-4-{4-[2-(4-morpholinyl)ethoxy]benzyl}-1,4-diazepan-1-yl)-2-methoxyethanone [ACD/IUPAC Name]
1-(6-Hydroxy-6-[(4-méthylphénoxy)méthyl]-4-{4-[2-(4-morpholinyl)éthoxy]benzyl}-1,4-diazépan-1-yl)-2-méthoxyéthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[hexahydro-6-hydroxy-6-[(4-methylphenoxy)methyl]-4-[[4-[2-(4-morpholinyl)ethoxy]phenyl]methyl]-1H-1,4-diazepin-1-yl]-2-methoxy- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 690.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.2±3.0 kJ/mol
Flash Point: 371.2±31.5 °C
Index of Refraction: 1.566
Molar Refractivity: 145.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 2.21
ACD/LogD (pH 5.5): 0.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.52
ACD/LogD (pH 7.4): 2.11
ACD/BCF (pH 7.4): 22.53
ACD/KOC (pH 7.4): 308.62
Polar Surface Area: 84 Å2
Polarizability: 57.5±0.5 10-24cm3
Surface Tension: 48.6±3.0 dyne/cm
Molar Volume: 445.0±3.0 cm3

Click to predict properties on the Chemicalize site


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