2-Methylthioxanthone
TL;DR: 2-Methylthioxanthone (CAS 15774-82-0) is a chemical compound with molecular formula C14H10OS and molecular weight 226.04524 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methylthioxanthen-9-one
Also Known As: 2-Methylthioxanthone, 2-Methylthiaxanthone, 2-Methylthioxanthen-9-one, 2-METHYL-9H-THIOXANTHEN-9-ONE, 9H-Thioxanthen-9-one, 2-methyl-
Application Areas
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H10OS |
| Molecular Weight | 226.04524 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 226.04524 Da |
| Heavy Atoms | 16 |
| Complexity | 288.0 |
| SMILES | CC1=CC2=C(C=C1)SC3=CC=CC=C3C2=O |
| InChIKey | MYISVPVWAQRUTL-UHFFFAOYSA-N |
Chemical Property Profile of 2-Methylthioxanthone
Property Insights of 2-Methylthioxanthone
The XLogP value of 4.4 indicates that 2-Methylthioxanthone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.4 Ų, 2-Methylthioxanthone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylthioxanthone 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
What is the CAS number of 2-Methylthioxanthone?
The CAS number of 2-Methylthioxanthone is 15774-82-0.
What is the molecular formula of 2-Methylthioxanthone?
The molecular formula of 2-Methylthioxanthone is C14H10OS.
What is the molecular weight of 2-Methylthioxanthone?
The molecular weight of 2-Methylthioxanthone is 226.04524 g/mol.
Where can I buy 2-Methylthioxanthone?
You can request a quote for 2-Methylthioxanthone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methylthioxanthone?
Yes, CoreyChem provides custom synthesis services for 2-Methylthioxanthone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.