N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide
TL;DR: N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide (CAS 123708-33-8) is a chemical compound with molecular formula C13H10BrN3O2S2 and molecular weight 382.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-4-bromo-2,1,3-benzothiadiazole-7-sulfonamide
Also Known As: N-benzyl-4-bromo-2,1,3-benzothiadiazole-7-sulfonamide, N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide, N-benzyl-7-bromobenzo[c][1,2,5]thiadiazole-4-sulfonamide, 7-Bromo-benzo[1,2,5]thiadiazole-4-sulfonic acid benzylamide
| Molecular Formula | C13H10BrN3O2S2 |
|---|---|
| Molecular Weight | 382.94 g/mol |
| LogP | 2.9323 |
| Topological Polar Surface Area | 71.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 382.9398 |
| Heavy Atoms | 21 |
| Complexity | 878.8276 |
Chemical Identifiers
| CAS Number | 123708-33-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNS(=O)(=O)C2=CC=C(C3=NSN=C23)Br |
Product Overview
N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide (CAS 123708-33-8), with molecular formula C13H10BrN3O2S2 and molecular weight 382.94 g/mol. IUPAC: N-benzyl-4-bromo-2,1,3-benzothiadiazole-7-sulfonamide.
Chemical Property Profile of N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide
Property Insights of N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide
The XLogP value of 2.9323 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide. The TPSA of 71.95 Ų falls within the moderate polarity range, balancing permeability and solubility for N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide. Following Lipinski's Rule of Five, N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide has 1 hydrogen bond donor(s) and 5 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 N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide?
The CAS number of N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide is 123708-33-8.
What is the molecular formula of N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide?
The molecular formula of N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide is C13H10BrN3O2S2.
What is the molecular weight of N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide?
The molecular weight of N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide is 382.94 g/mol.
Where can I buy N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide?
You can request a quote for N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-7-bromo-2,1,3-benzothiadiazole-4-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.