4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide
TL;DR: 4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide (CAS 331972-47-5) is a chemical compound with molecular formula C9H7BrN2O2S2 and molecular weight 317.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-(1,3-thiazol-2-yl)benzenesulfonamide
Also Known As: 4-Bromo-N-(thiazol-2-yl)benzenesulfonamide, 4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide, 4-bromo-N-(1,3-thiazol-2-yl)benzenesulfonamide, 4-Bromo-N-thiazol-2-yl-benzenesulfonamide, BAS 00719419
| Molecular Formula | C9H7BrN2O2S2 |
|---|---|
| Molecular Weight | 317.91 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 95.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 317.91324 |
| Heavy Atoms | 16 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 331972-47-5 |
|---|---|
| SMILES | C1=CC(=CC=C1S(=O)(=O)NC2=NC=CS2)Br |
| InChIKey | JNVLDSBNISCATL-UHFFFAOYSA-N |
Product Overview
4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide (CAS 331972-47-5), with molecular formula C9H7BrN2O2S2 and molecular weight 317.91 g/mol. IUPAC: 4-bromo-N-(1,3-thiazol-2-yl)benzenesulfonamide.
Chemical Property Profile of 4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide
Property Insights of 4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide. The TPSA of 95.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide. Following Lipinski's Rule of Five, 4-bromo-N-(1,3-thiazol-2-yl)benzene-1-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 4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide?
The CAS number of 4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide is 331972-47-5.
What is the molecular formula of 4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide?
The molecular formula of 4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide is C9H7BrN2O2S2.
What is the molecular weight of 4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide?
The molecular weight of 4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide is 317.91 g/mol.
Where can I buy 4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide?
You can request a quote for 4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.