2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro-
TL;DR: 2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro- (CAS 100638-20-8) is a chemical compound with molecular formula C8H6FNOS and molecular weight 183.01541 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-fluoro-4H-1,4-benzothiazin-3-one
Also Known As: 7-fluoro-2H-1,4-benzothiazin-3(4H)-one, 2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro-, 7-fluoro-4H-1,4-benzothiazin-3-one, 7-Fluoro-4H-benzo[1,4]thiazin-3-one, 7-fluoro-2H-benzo[b][1,4]thiazin-3(4H)-one
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H6FNOS |
| Molecular Weight | 183.01541 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 183.01541 Da |
| Heavy Atoms | 12 |
| Complexity | 199.0 |
| SMILES | C1C(=O)NC2=C(S1)C=C(C=C2)F |
| InChIKey | ZRSCIBYAOVOFIG-UHFFFAOYSA-N |
Chemical Property Profile of 2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro-
Property Insights of 2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro-. With a topological polar surface area (TPSA) of 54.4 Ų, 2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro-?
The CAS number of 2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro- is 100638-20-8.
What is the molecular formula of 2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro-?
The molecular formula of 2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro- is C8H6FNOS.
What is the molecular weight of 2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro-?
The molecular weight of 2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro- is 183.01541 g/mol.
Where can I buy 2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro-?
You can request a quote for 2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro-?
Yes, CoreyChem provides custom synthesis services for 2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.