Lucanthone Hydrochloride
TL;DR: Lucanthone Hydrochloride (CAS 548-57-2) is a chemical compound with molecular formula C20H25ClN2OS and molecular weight 376.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(diethylamino)ethylamino]-4-methylthioxanthen-9-one;hydrochloride
Also Known As: LUCANTHONE HYDROCHLORIDE, Miracol, Tixantone, Nilodin, Miracil D
| Molecular Formula | C20H25ClN2OS |
|---|---|
| Molecular Weight | 376.14 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 376.1376 |
| Heavy Atoms | 25 |
| Complexity | 426.0 |
| Melting Point | 195-196 °C |
| Solubility | Freely soluble in water. ... Slightly soluble in alcohol. |
Chemical Identifiers
| CAS Number | 548-57-2 |
|---|---|
| SMILES | CCN(CC)CCNC1=C2C(=C(C=C1)C)SC3=CC=CC=C3C2=O.Cl |
| InChIKey | LAOOXBLMIJHMFO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Lucanthone Hydrochloride (CAS 548-57-2), with molecular formula C20H25ClN2OS and molecular weight 376.14 g/mol. IUPAC: 1-[2-(diethylamino)ethylamino]-4-methylthioxanthen-9-one;hydrochloride.
Chemical Property Profile of Lucanthone Hydrochloride
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
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 376.14 g/mol.
Where can I buy Lucanthone Hydrochloride?
You can request a quote for Lucanthone Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lucanthone Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Lucanthone Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.