5-Fluorobenzo-2,1,3-thiadiazole
TL;DR: 5-Fluorobenzo-2,1,3-thiadiazole (CAS 17821-75-9) is a chemical compound with molecular formula C6H3FN2S and molecular weight 154.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-fluoro-2,1,3-benzothiadiazole
Also Known As: 5-Fluorobenzo-[2,1,3]-thiadiazole, 5-fluoro-2,1,3-benzothiadiazole, 5-fluorobenzo[c][1,2,5]thiadiazole, Maybridge1_006037, 5-fluorobenzo-2,1,3-thiadiazole
| Molecular Formula | C6H3FN2S |
|---|---|
| Molecular Weight | 154.00 g/mol |
| LogP | 1.8304 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 154.00009 |
| Heavy Atoms | 10 |
| Complexity | 357.2753 |
Chemical Identifiers
| CAS Number | 17821-75-9 |
|---|---|
| SMILES | C1=CC2=NSN=C2C=C1F |
Product Overview
5-Fluorobenzo-2,1,3-thiadiazole (CAS 17821-75-9), with molecular formula C6H3FN2S and molecular weight 154.00 g/mol. IUPAC: 5-fluoro-2,1,3-benzothiadiazole.
Chemical Property Profile of 5-Fluorobenzo-2,1,3-thiadiazole
Property Insights of 5-Fluorobenzo-2,1,3-thiadiazole
The XLogP value of 1.8304 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Fluorobenzo-2,1,3-thiadiazole. With a topological polar surface area (TPSA) of 25.78 Ų, 5-Fluorobenzo-2,1,3-thiadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Fluorobenzo-2,1,3-thiadiazole has 0 hydrogen bond donor(s) and 3 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 5-Fluorobenzo-2,1,3-thiadiazole?
The CAS number of 5-Fluorobenzo-2,1,3-thiadiazole is 17821-75-9.
What is the molecular formula of 5-Fluorobenzo-2,1,3-thiadiazole?
The molecular formula of 5-Fluorobenzo-2,1,3-thiadiazole is C6H3FN2S.
What is the molecular weight of 5-Fluorobenzo-2,1,3-thiadiazole?
The molecular weight of 5-Fluorobenzo-2,1,3-thiadiazole is 154.00 g/mol.
Where can I buy 5-Fluorobenzo-2,1,3-thiadiazole?
You can request a quote for 5-Fluorobenzo-2,1,3-thiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Fluorobenzo-2,1,3-thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Fluorobenzo-2,1,3-thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.