Cas no 1189443-74-0 (6-O-Desmethyl Donepezil-d5)

6-O-Desmethyl Donepezil-d5 is a deuterated analog of 6-O-desmethyl donepezil, a key metabolite of the acetylcholinesterase inhibitor donepezil. This isotopically labeled compound (d5) is designed for use as an internal standard in quantitative LC-MS/MS analyses, ensuring high precision and accuracy in pharmacokinetic and metabolic studies. The incorporation of five deuterium atoms enhances mass spectral differentiation, minimizing interference from endogenous compounds. Its structural fidelity to the parent metabolite allows for reliable calibration and validation in bioanalytical assays. This compound is particularly valuable for research involving donepezil metabolism, offering improved reproducibility and sensitivity in trace-level detection.
6-O-Desmethyl Donepezil-d5 structure
6-O-Desmethyl Donepezil-d5 structure
Product Name:6-O-Desmethyl Donepezil-d5
CAS No:1189443-74-0
MF:C23H27NO3
MW:370.496195077896
CID:1059004
PubChem ID:45038883
Update Time:2025-10-28

6-O-Desmethyl Donepezil-d5 Chemical and Physical Properties

Names and Identifiers

    • 6-O-Desmethyl Donepezil-d5
    • 6-hydroxy-5-methoxy-2-[[1-[(2,3,4,5,6-pentadeuteriophenyl)methyl]piperidin-4-yl]methyl]-2,3-dihydroinden-1-one
    • DTXSID00661897
    • 1189443-74-0
    • 1-(Benzyl-d5)-4-[(6-hydroxy-5-methoxy-1-oxo-indan-2-yl)methylpiperidine
    • CS-0202293
    • 6-Hydroxy-5-methoxy-2-({1-[(~2~H_5_)phenylmethyl]piperidin-4-yl}methyl)-2,3-dihydro-1H-inden-1-one
    • HY-133925S
    • Inchi: 1S/C23H27NO3/c1-27-22-13-18-12-19(23(26)20(18)14-21(22)25)11-16-7-9-24(10-8-16)15-17-5-3-2-4-6-17/h2-6,13-14,16,19,25H,7-12,15H2,1H3/i2D,3D,4D,5D,6D
    • InChI Key: DJRBBQJREIMIEU-VIQYUKPQSA-N
    • SMILES: O=C1C2C=C(C(=CC=2CC1CC1CCN(CC2C([2H])=C([2H])C([2H])=C([2H])C=2[2H])CC1)OC)O

Computed Properties

  • Exact Mass: 370.23000
  • Monoisotopic Mass: 370.23047745g/mol
  • Isotope Atom Count: 5
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 27
  • Rotatable Bond Count: 5
  • Complexity: 496
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.9
  • Topological Polar Surface Area: 49.8?2

Experimental Properties

  • Melting Point: 54-56°C
  • PSA: 49.77000
  • LogP: 3.99600

6-O-Desmethyl Donepezil-d5 Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
D292017-0.5mg
6-O-Desmethyl Donepezil-d5
1189443-74-0
0.5mg
$ 200.00 2023-02-03
TRC
D292017-5mg
6-O-Desmethyl Donepezil-d5
1189443-74-0
5mg
$ 1774.00 2023-09-08
TRC
D292017-.5mg
6-O-Desmethyl Donepezil-d5
1189443-74-0
.5mg
$ 230.00 2023-04-17

Additional information on 6-O-Desmethyl Donepezil-d5

Introduction to 6-O-Desmethyl Donepezil-d5 and Its Significance in Modern Medicinal Chemistry

The compound with the CAS no. 1189443-74-0, known as 6-O-Desmethyl Donepezil-d5, represents a critical derivative in the field of pharmaceutical chemistry. This deuterated analog of Donepezil, a well-known acetylcholinesterase inhibitor used primarily for the treatment of Alzheimer's disease, offers unique advantages in both research and clinical applications. The introduction of deuterium atoms at specific positions enhances the compound's metabolic stability and provides valuable insights into its pharmacokinetic behavior.

6-O-Desmethyl Donepezil-d5 is particularly significant in the context of drug metabolism and pharmacokinetic (DMPK) studies. The presence of deuterium atoms disrupts the metabolic pathways, making it an ideal tool for investigating the enzymatic processes involved in drug degradation. This has been increasingly relevant in recent years, as researchers strive to develop more efficient and targeted therapies for neurodegenerative disorders. The compound's stability under various metabolic conditions allows for precise tracking of its degradation products, which is essential for understanding its overall bioavailability and efficacy.

In the realm of medicinal chemistry, 6-O-Desmethyl Donepezil-d5 serves as a benchmark for developing new acetylcholinesterase inhibitors. The deuterated version not only retains the pharmacological activity of its parent compound but also offers improved analytical detection due to the enhanced mass spectrometry fragmentation patterns. This has been particularly useful in clinical trials and biomarker studies, where sensitive detection methods are crucial for monitoring drug efficacy and patient response.

Recent advancements in mass spectrometry techniques have further highlighted the importance of 6-O-Desmethyl Donepezil-d5 in drug development. Researchers have leveraged these techniques to study the compound's interactions with biological targets at a molecular level. This has led to a deeper understanding of how acetylcholinesterase inhibitors modulate neural activity, providing new avenues for therapeutic intervention. For instance, studies using 6-O-Desmethyl Donepezil-d5 have revealed insights into the compound's binding affinity and duration of action, which are critical parameters for optimizing drug design.

The pharmaceutical industry has also embraced 6-O-Desmethyl Donepezil-d5 as a key intermediate in the synthesis of novel acetylcholinesterase inhibitors. Its structural integrity and metabolic stability make it an excellent candidate for further chemical modifications. By incorporating this derivative into synthetic pathways, chemists can explore new chemical entities with enhanced pharmacological properties. This approach aligns with the growing trend toward personalized medicine, where tailored drug formulations are designed to meet individual patient needs.

From a regulatory perspective, 6-O-Desmethyl Donepezil-d5 has played a pivotal role in ensuring compliance with safety and efficacy standards. Regulatory agencies often require detailed pharmacokinetic data before approving new drugs, and 6-O-Desmethyl Donepezil-d5 provides comprehensive information on metabolic pathways and drug interactions. This has expedited the approval process for several acetylcholinesterase inhibitors, benefiting patients who rely on these medications for managing neurodegenerative conditions.

The future prospects of 6-O-Desmethyl Donepezil-d5 are promising, with ongoing research exploring its potential applications beyond Alzheimer's disease treatment. Studies suggest that this derivative may have therapeutic benefits in other neurological disorders, such as Parkinson's disease and cognitive impairment associated with aging. Additionally, its role in biomarker discovery is being explored, as researchers seek to identify reliable indicators of drug response and toxicity.

In conclusion, 6-O-Desmethyl Donepezil-d5 (CAS no. 1189443-74-0) is a cornerstone in modern medicinal chemistry, offering invaluable insights into drug metabolism, pharmacokinetics, and therapeutic development. Its unique properties make it an indispensable tool for researchers and clinicians alike, driving advancements in the treatment of neurodegenerative diseases and beyond. As our understanding of complex biological systems continues to evolve, compounds like 6-O-Desmethyl Donepezil-d5 will remain at the forefront of pharmaceutical innovation.

Recommended suppliers
Changzhou Guanjia Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Changzhou Guanjia Chemical Co., Ltd
上海帛亦醫(yī)藥科技有限公司
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Nantong Boya Environmental Protection Technology Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Nantong Boya Environmental Protection Technology Co., Ltd
NewCan Biotech Limited
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
NewCan Biotech Limited
Zhejiang Brunova Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Zhejiang Brunova Technology Co., Ltd.