![2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate structure](/static/products/496/496799-58-7.png)
2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate
TL;DR: 2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate (CAS 496799-58-7) is a chemical compound with molecular formula C12H5Cl3N2O3S2 and molecular weight 393.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4,6-trichlorophenyl) 2,1,3-benzothiadiazole-4-sulfonate
Also Known As: (2,4,6-trichlorophenyl) 2,1,3-benzothiadiazole-4-sulfonate, 2,4,6-trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate
| Molecular Formula | C12H5Cl3N2O3S2 |
|---|---|
| Molecular Weight | 393.88 g/mol |
| LogP | 4.4192 |
| Topological Polar Surface Area | 69.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 393.8807 |
| Heavy Atoms | 22 |
| Complexity | 949.657 |
Chemical Identifiers
| CAS Number | 496799-58-7 |
|---|---|
| SMILES | C1=CC2=NSN=C2C(=C1)S(=O)(=O)OC3=C(C=C(C=C3Cl)Cl)Cl |
Product Overview
2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate (CAS 496799-58-7), with molecular formula C12H5Cl3N2O3S2 and molecular weight 393.88 g/mol. IUPAC: (2,4,6-trichlorophenyl) 2,1,3-benzothiadiazole-4-sulfonate.
Chemical Property Profile of 2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate
Property Insights of 2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate
The XLogP value of 4.4192 indicates that 2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate. Following Lipinski's Rule of Five, 2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate has 0 hydrogen bond donor(s) and 6 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 2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate?
The CAS number of 2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate is 496799-58-7.
What is the molecular formula of 2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate?
The molecular formula of 2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate is C12H5Cl3N2O3S2.
What is the molecular weight of 2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate?
The molecular weight of 2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate is 393.88 g/mol.
Where can I buy 2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate?
You can request a quote for 2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Trichlorophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.