10-thioxo-9(10H)-anthracenone
TL;DR: 10-thioxo-9(10H)-anthracenone (CAS 68629-85-6) is a chemical compound with molecular formula C14H8OS and molecular weight 224.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-sulfanylideneanthracen-9-one
Also Known As: Thioanthrachinone, 10-thioxo-9(10H)-anthracenone, 10-Thioxoanthracen-9(10H)-one, 9-Thioxoanthracene-10-one, 10-thioxo-anthracen-9-one
| Molecular Formula | C14H8OS |
|---|---|
| Molecular Weight | 224.03 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 49.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 224.02959 |
| Heavy Atoms | 16 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 68629-85-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3C2=S |
| InChIKey | JCYMHIDMZZHHQC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
10-thioxo-9(10H)-anthracenone (CAS 68629-85-6), with molecular formula C14H8OS and molecular weight 224.03 g/mol. IUPAC: 10-sulfanylideneanthracen-9-one.
Chemical Property Profile of 10-thioxo-9(10H)-anthracenone
Property Insights of 10-thioxo-9(10H)-anthracenone
The XLogP value of 4.0 indicates that 10-thioxo-9(10H)-anthracenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.2 Ų, 10-thioxo-9(10H)-anthracenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 10-thioxo-9(10H)-anthracenone 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 10-thioxo-9(10H)-anthracenone?
The CAS number of 10-thioxo-9(10H)-anthracenone is 68629-85-6.
What is the molecular formula of 10-thioxo-9(10H)-anthracenone?
The molecular formula of 10-thioxo-9(10H)-anthracenone is C14H8OS.
What is the molecular weight of 10-thioxo-9(10H)-anthracenone?
The molecular weight of 10-thioxo-9(10H)-anthracenone is 224.03 g/mol.
Where can I buy 10-thioxo-9(10H)-anthracenone?
You can request a quote for 10-thioxo-9(10H)-anthracenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10-thioxo-9(10H)-anthracenone?
Yes, KEHONG BIO provides custom synthesis services for 10-thioxo-9(10H)-anthracenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.