Xanthene-9-Thione
TL;DR: Xanthene-9-Thione (CAS 492-21-7) is a chemical compound with molecular formula C13H8OS and molecular weight 212.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
xanthene-9-thione
Also Known As: Xanthene-9-thione, 9H-Xanthene-9-thione, Xanthione, Xanthenethione, 9-thioxanthenone
| Molecular Formula | C13H8OS |
|---|---|
| Molecular Weight | 212.03 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 41.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 212.02959 |
| Heavy Atoms | 15 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 492-21-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=S)C3=CC=CC=C3O2 |
| InChIKey | VKLOKHJKPPJQMM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Xanthene-9-Thione (CAS 492-21-7), with molecular formula C13H8OS and molecular weight 212.03 g/mol. IUPAC: xanthene-9-thione.
Chemical Property Profile of Xanthene-9-Thione
Property Insights of Xanthene-9-Thione
The XLogP value of 4.0 indicates that Xanthene-9-Thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.3 Ų, Xanthene-9-Thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Xanthene-9-Thione has 0 hydrogen bond donor(s) and 2 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 Xanthene-9-Thione?
The CAS number of Xanthene-9-Thione is 492-21-7.
What is the molecular formula of Xanthene-9-Thione?
The molecular formula of Xanthene-9-Thione is C13H8OS.
What is the molecular weight of Xanthene-9-Thione?
The molecular weight of Xanthene-9-Thione is 212.03 g/mol.
Where can I buy Xanthene-9-Thione?
You can request a quote for Xanthene-9-Thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Xanthene-9-Thione?
Yes, KEHONG BIO provides custom synthesis services for Xanthene-9-Thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.