N-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide
TL;DR: N-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide (CAS 443104-98-1) is a chemical compound with molecular formula C12H7F2N3O2S2 and molecular weight 326.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide
Also Known As: N-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide, (benzo[2,3-c]1,2,5-thiadiazol-4-ylsulfonyl)(2,5-difluorophenyl)amine, N-(2,5-difluorophenyl)-8-thia-7,9-diazabicyclo[4.3.0]nona-2,4,6,9-tetraene-2-sulfonamide
| Molecular Formula | C12H7F2N3O2S2 |
|---|---|
| Molecular Weight | 326.99 g/mol |
| LogP | 2.7703 |
| Topological Polar Surface Area | 71.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 326.99478 |
| Heavy Atoms | 21 |
| Complexity | 925.15216 |
Chemical Identifiers
| CAS Number | 443104-98-1 |
|---|---|
| SMILES | C1=CC2=NSN=C2C(=C1)S(=O)(=O)NC3=C(C=CC(=C3)F)F |
Product Overview
N-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide (CAS 443104-98-1), with molecular formula C12H7F2N3O2S2 and molecular weight 326.99 g/mol. IUPAC: N-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide.
Chemical Property Profile of N-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide
Property Insights of N-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide
The XLogP value of 2.7703 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide. The TPSA of 71.95 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide. Following Lipinski's Rule of Five, N-(2,5-difluorophenyl)-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-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide?
The CAS number of N-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide is 443104-98-1.
What is the molecular formula of N-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide?
The molecular formula of N-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide is C12H7F2N3O2S2.
What is the molecular weight of N-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide?
The molecular weight of N-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide is 326.99 g/mol.
Where can I buy N-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide?
You can request a quote for N-(2,5-difluorophenyl)-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-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,5-difluorophenyl)-2,1,3-benzothiadiazole-4-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.