5-Chloro-1,2,3-thiadiazole
TL;DR: 5-Chloro-1,2,3-thiadiazole (CAS 4113-57-9) is a chemical compound with molecular formula C2HClN2S and molecular weight 119.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chlorothiadiazole
Also Known As: 5-Chloro-1,2,3-thiadiazole, 5-chlorothiadiazole, Pachymicacid, C2HClN2S, 1,2,3-Thiadiazole,5-chloro
| Molecular Formula | C2HClN2S |
|---|---|
| Molecular Weight | 119.95 g/mol |
| LogP | 1.1915 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 119.954895 |
| Heavy Atoms | 6 |
| Complexity | 115.108505 |
Chemical Identifiers
| CAS Number | 4113-57-9 |
|---|---|
| SMILES | C1=C(SN=N1)Cl |
Product Overview
5-Chloro-1,2,3-thiadiazole (CAS 4113-57-9), with molecular formula C2HClN2S and molecular weight 119.95 g/mol. IUPAC: 5-chlorothiadiazole.
Chemical Property Profile of 5-Chloro-1,2,3-thiadiazole
Property Insights of 5-Chloro-1,2,3-thiadiazole
The XLogP value of 1.1915 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-1,2,3-thiadiazole. With a topological polar surface area (TPSA) of 25.78 Ų, 5-Chloro-1,2,3-thiadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-1,2,3-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-Chloro-1,2,3-thiadiazole?
The CAS number of 5-Chloro-1,2,3-thiadiazole is 4113-57-9.
What is the molecular formula of 5-Chloro-1,2,3-thiadiazole?
The molecular formula of 5-Chloro-1,2,3-thiadiazole is C2HClN2S.
What is the molecular weight of 5-Chloro-1,2,3-thiadiazole?
The molecular weight of 5-Chloro-1,2,3-thiadiazole is 119.95 g/mol.
Where can I buy 5-Chloro-1,2,3-thiadiazole?
You can request a quote for 5-Chloro-1,2,3-thiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-1,2,3-thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-1,2,3-thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.