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Lucanthone Hydrochloride structure
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Lucanthone Hydrochloride

TL;DR: Lucanthone Hydrochloride (CAS 548-57-2) is a chemical compound with molecular formula C20H25ClN2OS and molecular weight 376.1376 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-[2-(diethylamino)ethylamino]-4-methylthioxanthen-9-one;hydrochloride

Also Known As: LUCANTHONE HYDROCHLORIDE, Miracol, Tixantone, Nilodin, Miracil D

CAS Number
548-57-2
Molecular Formula
C20H25ClN2OS
Molecular Weight
376.1376 g/mol
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Application Areas

Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (63 patents) Analytical Reagents (39 patents) Biotechnology (260 patents) Coatings & Adhesives (3 patents) Electronic Chemicals (4 patents)

Technical Specifications

Molecular FormulaC20H25ClN2OS
Molecular Weight376.1376 g/mol
XLogP4.9
Topological Polar Surface Area (TPSA)57.6 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds6
Exact Mass376.1376 Da
Heavy Atoms25
Complexity426.0
Melting Point195-196 °C
SolubilityFreely soluble in water. ... Slightly soluble in alcohol.
SMILESCCN(CC)CCNC1=C2C(=C(C=C1)C)SC3=CC=CC=C3C2=O.Cl
InChIKeyLAOOXBLMIJHMFO-UHFFFAOYSA-N

Product Description

Applications: Lucanthone Hydrochloride is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Lucanthone Hydrochloride (CAS 548-57-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

A pharmaceutical intermediate supplied by CoreyChem, Lucanthone Hydrochloride (CAS 548-57-2) has the molecular formula C20H25ClN2OS and a molecular weight of 376.14 g/mol. Reported properties include a solubility: Freely soluble in water. ... Slightly soluble in alcohol. It is also known as LUCANTHONE HYDROCHLORIDE and Miracol.

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 Lucanthone Hydrochloride

XLogP
4.9
TPSA (Topological Polar Surface Area)
57.6
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
6
Heavy Atoms
25
Complexity
426.0
Exact Mass
376.1376
Monoisotopic Mass
376.1376
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 Lucanthone Hydrochloride

The XLogP value of 4.9 indicates that Lucanthone Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.6 Ų, Lucanthone Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Lucanthone Hydrochloride has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Lucanthone Hydrochloride?

The CAS number of Lucanthone Hydrochloride is 548-57-2.

What is the molecular formula of Lucanthone Hydrochloride?

The molecular formula of Lucanthone Hydrochloride is C20H25ClN2OS.

What is the molecular weight of Lucanthone Hydrochloride?

The molecular weight of Lucanthone Hydrochloride is 376.1376 g/mol.

What are the applications of Lucanthone Hydrochloride?

Lucanthone Hydrochloride is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Lucanthone Hydrochloride (CAS...

Where can I buy Lucanthone Hydrochloride?

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

Does CoreyChem offer custom synthesis for Lucanthone Hydrochloride?

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

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