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Metizoline Hydrochloride structure
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Metizoline Hydrochloride

TL;DR: Metizoline Hydrochloride (CAS 5090-37-9) is a chemical compound with molecular formula C13H15ClN2S and molecular weight 266.06445 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[(2-methyl-1-benzothiophen-3-yl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride

Also Known As: Metizoline hydrochloride, Ellsyl, Metizoline HCl, Eunasin, Metyzoline

CAS Number
5090-37-9
Molecular Formula
C13H15ClN2S
Molecular Weight
266.06445 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (1 patents) Pharmaceutical Intermediates (42 patents)

Technical Specifications

Molecular FormulaC13H15ClN2S
Molecular Weight266.06445 g/mol
XLogP3.18
Topological Polar Surface Area (TPSA)52.6 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors2
Rotatable Bonds2
Exact Mass266.06445 Da
Heavy Atoms17
Complexity290.0
SMILESCC1=C(C2=CC=CC=C2S1)CC3=NCCN3.Cl
InChIKeyFPTJVMYMFXHIFO-UHFFFAOYSA-N

Chemical Property Profile of Metizoline Hydrochloride

XLogP
3.18
TPSA (Topological Polar Surface Area)
52.6
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
2
Rotatable Bonds
2
Heavy Atoms
17
Complexity
290.0
Exact Mass
266.06445
Monoisotopic Mass
266.06445
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 Metizoline Hydrochloride

The XLogP value of 3.18 indicates that Metizoline Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Metizoline Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Metizoline Hydrochloride has 2 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 Metizoline Hydrochloride?

The CAS number of Metizoline Hydrochloride is 5090-37-9.

What is the molecular formula of Metizoline Hydrochloride?

The molecular formula of Metizoline Hydrochloride is C13H15ClN2S.

What is the molecular weight of Metizoline Hydrochloride?

The molecular weight of Metizoline Hydrochloride is 266.06445 g/mol.

Where can I buy Metizoline Hydrochloride?

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

Does CoreyChem offer custom synthesis for Metizoline Hydrochloride?

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

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