Lucanthone N-oxide
TL;DR: Lucanthone N-oxide (CAS 5615-06-5) is a chemical compound with molecular formula C20H24N2O2S and molecular weight 356.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-2-[(4-methyl-9-oxothioxanthen-1-yl)amino]ethanamine oxide
Also Known As: Lucanthone N-oxide, N,N-diethyl-2-[(4-methyl-9-oxothioxanthen-1-yl)amino]ethanamine oxide, N-[2-(diethylamino)ethyl]-4-methyl-9-oxothioxanthen-1-amine oxide, Thioxanthen-9-one, 1-((2-(diethylamino)ethyl)amino)-4-methyl-, N-oxide, 1-((2-(Diethylamino)ethyl)amino)-4-methylthioxanthen-9-one N-oxide
| Molecular Formula | C20H24N2O2S |
|---|---|
| Molecular Weight | 356.16 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 72.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 356.15585 |
| Heavy Atoms | 25 |
| Complexity | 469.0 |
Chemical Identifiers
| CAS Number | 5615-06-5 |
|---|---|
| SMILES | CC[N+](CC)(CCNC1=C2C(=C(C=C1)C)SC3=CC=CC=C3C2=O)[O-] |
| InChIKey | ZDSNQHIOBHSSFP-UHFFFAOYSA-N |
Product Overview
Lucanthone N-oxide (CAS 5615-06-5), with molecular formula C20H24N2O2S and molecular weight 356.16 g/mol. IUPAC: N,N-diethyl-2-[(4-methyl-9-oxothioxanthen-1-yl)amino]ethanamine oxide.
Chemical Property Profile of Lucanthone N-oxide
Property Insights of Lucanthone N-oxide
The XLogP value of 3.4 indicates that Lucanthone N-oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Lucanthone N-oxide. Following Lipinski's Rule of Five, Lucanthone N-oxide has 1 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 N-oxide?
The CAS number of Lucanthone N-oxide is 5615-06-5.
What is the molecular formula of Lucanthone N-oxide?
The molecular formula of Lucanthone N-oxide is C20H24N2O2S.
What is the molecular weight of Lucanthone N-oxide?
The molecular weight of Lucanthone N-oxide is 356.16 g/mol.
Where can I buy Lucanthone N-oxide?
You can request a quote for Lucanthone N-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lucanthone N-oxide?
Yes, KEHONG BIO provides custom synthesis services for Lucanthone N-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.