CAS 1263184-13-9|Norgestimate metabolite norelgestromin-d6

Introduction:Basic information about CAS 1263184-13-9|Norgestimate metabolite norelgestromin-d6, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameNorgestimate metabolite norelgestromin-d6
CAS Number1263184-13-9Molecular Weight333.50
Density1.2±0.1 g/cm3Boiling Point491.9±45.0 °C at 760 mmHg
Molecular FormulaC21H23D6NO2Melting Point/
MSDS/Flash Point327.1±18.0 °C

Names

Name17-Desacetyl Norgestimate-d6 (Mixture of Isomers)

BiologicalActivity

DescriptionNorgestimate metabolite norelgestromin-d6 is the deuterium labeled Norgestimate metabolite norelgestromin. Norelgestromin is a metabolite of Norgestimate, which is a progestin or synthetic progestogen.
In VitroStable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and metabolic profiles of drugs[1].
References

[1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53(2):211-216.

Chemical & Physical Properties

Density1.2±0.1 g/cm3
Boiling Point491.9±45.0 °C at 760 mmHg
Molecular FormulaC21H23D6NO2
Molecular Weight333.50
Flash Point327.1±18.0 °C
Exact Mass333.257477
LogP4.40
Vapour Pressure0.0±2.8 mmHg at 25°C
Index of Refraction1.633
InChIKeyISHXLNHNDMZNMC-IACROPEISA-N
SMILESC#CC1(O)CCC2C3CCC4=CC(=NO)CCC4C3CCC21CC
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