5-Chloro-4-phenyl-1,2,3-thiadiazole
TL;DR: 5-Chloro-4-phenyl-1,2,3-thiadiazole (CAS 53646-00-7) is a chemical compound with molecular formula C8H5ClN2S and molecular weight 195.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-4-phenylthiadiazole
Also Known As: 5-chloro-4-phenyl-1,2,3-thiadiazole, 5-chloro-4-phenylthiadiazole, 2-Fluoro-5-nitrotoluene, 5-chloro-4-phenyl-thiadiazole, 4-Phenyl-5-chloro-1,2,3-thiadiazole
| Molecular Formula | C8H5ClN2S |
|---|---|
| Molecular Weight | 195.99 g/mol |
| LogP | 2.8585 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 195.98619 |
| Heavy Atoms | 12 |
| Complexity | 371.5567 |
Chemical Identifiers
| CAS Number | 53646-00-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(SN=N2)Cl |
Product Overview
5-Chloro-4-phenyl-1,2,3-thiadiazole (CAS 53646-00-7), with molecular formula C8H5ClN2S and molecular weight 195.99 g/mol. IUPAC: 5-chloro-4-phenylthiadiazole.
Chemical Property Profile of 5-Chloro-4-phenyl-1,2,3-thiadiazole
Property Insights of 5-Chloro-4-phenyl-1,2,3-thiadiazole
The XLogP value of 2.8585 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-4-phenyl-1,2,3-thiadiazole. With a topological polar surface area (TPSA) of 25.78 Ų, 5-Chloro-4-phenyl-1,2,3-thiadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-4-phenyl-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-4-phenyl-1,2,3-thiadiazole?
The CAS number of 5-Chloro-4-phenyl-1,2,3-thiadiazole is 53646-00-7.
What is the molecular formula of 5-Chloro-4-phenyl-1,2,3-thiadiazole?
The molecular formula of 5-Chloro-4-phenyl-1,2,3-thiadiazole is C8H5ClN2S.
What is the molecular weight of 5-Chloro-4-phenyl-1,2,3-thiadiazole?
The molecular weight of 5-Chloro-4-phenyl-1,2,3-thiadiazole is 195.99 g/mol.
Where can I buy 5-Chloro-4-phenyl-1,2,3-thiadiazole?
You can request a quote for 5-Chloro-4-phenyl-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-4-phenyl-1,2,3-thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-4-phenyl-1,2,3-thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.