ChemSpider 2D Image | (2beta,3alpha,5beta,8alpha,13alpha,14beta,16alpha,17alpha)-3,17-Diacetoxy-2,16-bis(1-methyl-1-piperidiniumyl)androstane | C35H60N2O4

(2β,3α,5β,8α,13α,14β,16α,17α)-3,17-Diacetoxy-2,16-bis(1-methyl-1-piperidiniumyl)androstane

  • Molecular FormulaC35H60N2O4
  • Average mass572.861 Da
  • Monoisotopic mass572.454224 Da
  • ChemSpider ID5037008

  • Charge - Charge

    defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(2β,3α,5β,8α,13α,14β,16α,17α)-3,17-Diacetoxy-2,16-bis(1-methyl-1-piperidiniumyl)androstan [German] [ACD/IUPAC Name]
(2β,3α,5β,8α,13α,14β,16α,17α)-3,17-Diacetoxy-2,16-bis(1-methyl-1-piperidiniumyl)androstane [ACD/IUPAC Name]
(2β,3α,5β,8α,13α,14β,16α,17α)-3,17-Diacétoxy-2,16-bis(1-méthyl-1-pipéridiniumyl)androstane [French] [ACD/IUPAC Name]
Androstane-3,17-diol, 2,16-bis(1-methyl-1-piperidiniumyl)-, diacetate (ester), (2β,3α,5β,8α,13α,14β,16α,17α)- [ACD/Index Name]

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

NCGC00024736-01 [DBID]
Tocris-0693 [DBID]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 0.75
ACD/LogD (pH 5.5): -2.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.75
ACD/LogD (pH 7.4): -2.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.75
Polar Surface Area: 53 Å2
Polarizability:
Surface Tension:
Molar Volume:

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