ChemSpider 2D Image | (2alpha,3beta,8xi,9xi,14xi,16alpha,17alpha)-3,17-Diacetoxy-2,16-bis(4,4-dimethylpiperazin-4-ium-1-yl)androstane | C35H62N4O4

(2α,3β,8ξ,9ξ,14ξ,16α,17α)-3,17-Diacetoxy-2,16-bis(4,4-dimethylpiperazin-4-ium-1-yl)androstane

  • Molecular FormulaC35H62N4O4
  • Average mass602.890 Da
  • Monoisotopic mass602.476013 Da
  • ChemSpider ID4886574

  • Charge - Charge

    defined stereocentres - 6 of 10 defined stereocentres

More details:

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

(2α,3β,8ξ,9ξ,14ξ,16α,17α)-3,17-Diacetoxy-2,16-bis(4,4-dimethylpiperazin-4-ium-1-yl)androstan [German] [ACD/IUPAC Name]
(2α,3β,8ξ,9ξ,14ξ,16α,17α)-3,17-Diacetoxy-2,16-bis(4,4-dimethylpiperazin-4-ium-1-yl)androstane [ACD/IUPAC Name]
(2α,3β,8ξ,9ξ,14ξ,16α,17α)-3,17-Diacétoxy-2,16-bis(4,4-diméthylpipérazin-4-ium-1-yl)androstane [French] [ACD/IUPAC Name]
Androstane-3,17-diol, 2,16-bis(4,4-dimethyl-1-piperaziniumyl)-, diacetate (ester), (2α,3β,8ξ,9ξ,14ξ,16α,17α)- [ACD/Index Name]

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: 8
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 0.80
ACD/LogD (pH 5.5): -2.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 59 Å2
Polarizability:
Surface Tension:
Molar Volume:

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