ChemSpider 2D Image | Testosterone-3-CMO: ABEI | C35H49N5O5

Testosterone-3-CMO: ABEI

  • Molecular FormulaC35H49N5O5
  • Average mass619.794 Da
  • Monoisotopic mass619.373352 Da
  • ChemSpider ID57539180

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 6 of 6 defined stereocentres

More details:

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

82546-60-9 [RN]
Acetamide, N-[4-[ethyl(1,2,3,4-tetrahydro-1,4-dioxo-6-phthalazinyl)amino]butyl]-2-[[[(3E,17β)-17-hydroxyandrost-4-en-3-ylidene]amino]oxy]- [ACD/Index Name]
N-{4-[(1,4-Dioxo-1,2,3,4-tétrahydro-6-phtalazinyl)(éthyl)amino]butyl}-2-({(E)-[(3E,17β)-17-hydroxyandrost-4-én-3-ylidène]amino}oxy)acétamide [French] [ACD/IUPAC Name]
N-{4-[(1,4-Dioxo-1,2,3,4-tetrahydro-6-phthalazinyl)(ethyl)amino]butyl}-2-({(E)-[(3E,17β)-17-hydroxyandrost-4-en-3-yliden]amino}oxy)acetamid [German] [ACD/IUPAC Name]
N-{4-[(1,4-Dioxo-1,2,3,4-tetrahydro-6-phthalazinyl)(ethyl)amino]butyl}-2-({(E)-[(3E,17β)-17-hydroxyandrost-4-en-3-ylidene]amino}oxy)acetamide [ACD/IUPAC Name]
Testosterone-3-CMO: ABEI
N-{4-[(1,4-Dioxo-1,2,3,4-tetrahydrophthalazin-6-yl)(ethyl)amino]butyl}-2-({(E)-[(3E,17β)-17-hydroxyandrost-4-en-3-ylidene]amino}oxy)acetamide
Testosterone-3-(O-carboxymethyl)oxime-N-(4-aminobutyl)-N-ethylisoluminol conjugate

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.666
Molar Refractivity: 170.0±0.5 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 5.13
ACD/LogD (pH 5.5): 4.04
ACD/BCF (pH 5.5): 695.87
ACD/KOC (pH 5.5): 3761.52
ACD/LogD (pH 7.4): 4.05
ACD/BCF (pH 7.4): 700.52
ACD/KOC (pH 7.4): 3786.66
Polar Surface Area: 132 Å2
Polarizability: 67.4±0.5 10-24cm3
Surface Tension: 54.0±7.0 dyne/cm
Molar Volume: 457.1±7.0 cm3

Click to predict properties on the Chemicalize site


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