2-[2-(4-Fluorophenyl)-2-oxo-1-phenyl-d5-ethyl]-4-methyl-3-oxo-pentanoic Acid, (4-Benzyloxy-phenyl)-a

For research use only. Not for therapeutic Use.

  • CAT Number: R003754
  • CAS Number: 1020719-44-1
  • Molecular Formula: C33H30FNO4
  • Molecular Weight: 528.64
  • Purity: ≥95%
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2-[2-(4-Fluorophenyl)-2-oxo-1-phenyl-d5-ethyl]-4-methyl-3-oxo-pentanoic Acid, (4-Benzyloxy-phenyl)-a(Cat No.:R003754) is a complex organic molecule with a deuterated ethyl group where five hydrogen atoms are replaced with deuterium. This compound likely serves as an intermediate or a potential therapeutic agent, given its intricate structure involving a keto-pentanoic acid backbone, fluorophenyl, and benzyloxy-phenyl groups. The deuteration enhances its stability, crucial for detailed pharmacokinetic or metabolic studies. Such a compound could be of interest in medicinal chemistry for developing new drugs with specific targeting capabilities or improved metabolic stability, especially in the realm of metabolic diseases or cancer.


Catalog Number R003754
CAS Number 1020719-44-1
Synonyms

4-Fluoro-α-(2-methyl-1-oxopropyl)-γ-oxo-β-phenyl-N-[4-(phenylmethoxy)phenyl]benzenebutanamide-d5; 4-Methyl-3-oxo-N-(4-benzyloxyphenyl)-2-[1-phenyl-2-(4-fluorophenyl)-2-oxoethyl]pentamide-d5;

Molecular Formula C33H30FNO4
Purity ≥95%
Storage -20°C
IUPAC Name 2-[2-(4-fluorophenyl)-2-oxo-1-(2,3,4,5,6-pentadeuteriophenyl)ethyl]-4-methyl-3-oxo-N-(4-phenylmethoxyphenyl)pentanamide
InChI InChI=1S/C33H30FNO4/c1-22(2)31(36)30(29(24-11-7-4-8-12-24)32(37)25-13-15-26(34)16-14-25)33(38)35-27-17-19-28(20-18-27)39-21-23-9-5-3-6-10-23/h3-20,22,29-30H,21H2,1-2H3,(H,35,38)/i4D,7D,8D,11D,12D
InChIKey GQGGAQUHBXLZMT-SCUSKTIWSA-N
SMILES [2H]C1=C(C(=C(C(=C1[2H])[2H])C(C(C(=O)C(C)C)C(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)F)[2H])[2H]

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