ChemSpider 2D Image | 7-[4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-13-ethyl-9-(5-hydroxy-4-methoxy-4,6-dimethyl-tetrahydropyran-2-yl)oxy-6-methoxy-2,4,6,8,10,14-hexamethyl-17-[4-[4-(3-pyridyl)imidazol-1-yl]butyl]-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,11,16-trione | C51H81N5O13

7-[4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-13-ethyl-9-(5-hydroxy-4-methoxy-4,6-dimethyl-tetrahydropyran-2-yl)oxy-6-methoxy-2,4,6,8,10,14-hexamethyl-17-[4-[4-(3-pyridyl)imidazol-1-yl]butyl]-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,11,16-trione

  • Molecular FormulaC51H81N5O13
  • Average mass972.214 Da
  • Monoisotopic mass971.583069 Da
  • ChemSpider ID22378150

More details:

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

Density: 1.3±0.1 g/cm3
Boiling Point: 1039.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 159.2±3.0 kJ/mol
Flash Point: 582.2±34.3 °C
Index of Refraction: 1.582
Molar Refractivity: 254.7±0.5 cm3
#H bond acceptors: 18
#H bond donors: 2
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: 5.81
ACD/LogD (pH 5.5): 2.93
ACD/BCF (pH 5.5): 25.15
ACD/KOC (pH 5.5): 68.34
ACD/LogD (pH 7.4): 4.68
ACD/BCF (pH 7.4): 1414.42
ACD/KOC (pH 7.4): 3843.05
Polar Surface Area: 203 Å2
Polarizability: 101.0±0.5 10-24cm3
Surface Tension: 43.3±7.0 dyne/cm
Molar Volume: 763.2±7.0 cm3

Click to predict properties on the Chemicalize site


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