![2-Nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate structure](/static/products/496/496775-15-6.png)
2-Nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate
TL;DR: 2-Nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate (CAS 496775-15-6) is a chemical compound with molecular formula C12H7N3O5S2 and molecular weight 336.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-nitrophenyl) 2,1,3-benzothiadiazole-4-sulfonate
Also Known As: (2-nitrophenyl) 2,1,3-benzothiadiazole-4-sulfonate, 2-nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate
| Molecular Formula | C12H7N3O5S2 |
|---|---|
| Molecular Weight | 336.98 g/mol |
| LogP | 2.3672 |
| Topological Polar Surface Area | 112.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 336.98273 |
| Heavy Atoms | 22 |
| Complexity | 967.562 |
Chemical Identifiers
| CAS Number | 496775-15-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)[N+](=O)[O-])OS(=O)(=O)C2=CC=CC3=NSN=C32 |
Product Overview
2-Nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate (CAS 496775-15-6), with molecular formula C12H7N3O5S2 and molecular weight 336.98 g/mol. IUPAC: (2-nitrophenyl) 2,1,3-benzothiadiazole-4-sulfonate.
Chemical Property Profile of 2-Nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate
Property Insights of 2-Nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate
The XLogP value of 2.3672 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate. The TPSA of 112.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate. Following Lipinski's Rule of Five, 2-Nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate has 0 hydrogen bond donor(s) and 8 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-Nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate?
The CAS number of 2-Nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate is 496775-15-6.
What is the molecular formula of 2-Nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate?
The molecular formula of 2-Nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate is C12H7N3O5S2.
What is the molecular weight of 2-Nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate?
The molecular weight of 2-Nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate is 336.98 g/mol.
Where can I buy 2-Nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate?
You can request a quote for 2-Nitrophenyl 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-Nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-Nitrophenyl benzo[c][1,2,5]thiadiazole-4-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.