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Nordoxepin structure
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Nordoxepin

TL;DR: Nordoxepin (CAS 1225-56-5) is a chemical compound with molecular formula C18H19NO and molecular weight 265.14667 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N-methylpropan-1-amine

Also Known As: Desmethyldoxepin, Demethyldoxepin, Nordoxepin, desmethyldoxepine, Desmethyl doxepin

CAS Number
1225-56-5
Molecular Formula
C18H19NO
Molecular Weight
265.14667 g/mol
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Application Areas

Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (13 patents) Organic Building Blocks (5 patents) Pharmaceutical Intermediates (9 patents)

Technical Specifications

Molecular FormulaC18H19NO
Molecular Weight265.14667 g/mol
XLogP3.8
Topological Polar Surface Area (TPSA)21.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds3
Exact Mass265.14667 Da
Heavy Atoms20
Complexity338.0
SMILESCNCCC=C1C2=CC=CC=C2COC3=CC=CC=C31
InChIKeyHVKCEFHNSNZIHO-UHFFFAOYSA-N

Product Description

Applications: Nordoxepin is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Nordoxepin (CAS 1225-56-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Nordoxepin is a heterocyclic building block identified by CAS number 1225-56-5 and the molecular formula C18H19NO and a molecular weight of 265.15 g/mol. It is also known as Desmethyldoxepin and Demethyldoxepin.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Nordoxepin

XLogP
3.8
TPSA (Topological Polar Surface Area)
21.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
3
Heavy Atoms
20
Complexity
338.0
Exact Mass
265.14667
Monoisotopic Mass
265.14667
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Nordoxepin

The XLogP value of 3.8 indicates that Nordoxepin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.3 Ų, Nordoxepin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nordoxepin has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Nordoxepin?

The CAS number of Nordoxepin is 1225-56-5.

What is the molecular formula of Nordoxepin?

The molecular formula of Nordoxepin is C18H19NO.

What is the molecular weight of Nordoxepin?

The molecular weight of Nordoxepin is 265.14667 g/mol.

What are the applications of Nordoxepin?

Nordoxepin is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Nordoxepin (CAS 1225-56-5) with custom...

Where can I buy Nordoxepin?

You can request a quote for Nordoxepin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Nordoxepin?

Yes, CoreyChem provides custom synthesis services for Nordoxepin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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