N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide
TL;DR: N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide (CAS 326901-85-3) is a chemical compound with molecular formula C13H9FN2O2S2 and molecular weight 308.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide
Also Known As: N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide, BAS 00627761, benzothiazol-2-yl[(4-fluorophenyl)sulfonyl]amine, J3.154.533A, N-Benzothiazol-2-yl-4-fluoro-benzenesulfonamide
| Molecular Formula | C13H9FN2O2S2 |
|---|---|
| Molecular Weight | 308.01 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 95.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.00894 |
| Heavy Atoms | 20 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 326901-85-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)NS(=O)(=O)C3=CC=C(C=C3)F |
| InChIKey | DNTVJOUAMXCLOY-UHFFFAOYSA-N |
Product Overview
N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide (CAS 326901-85-3), with molecular formula C13H9FN2O2S2 and molecular weight 308.01 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide.
Chemical Property Profile of N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide
Property Insights of N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide
The XLogP value of 3.3 indicates that N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide. Following Lipinski's Rule of Five, N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide has 1 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 N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide?
The CAS number of N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide is 326901-85-3.
What is the molecular formula of N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide?
The molecular formula of N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide is C13H9FN2O2S2.
What is the molecular weight of N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide?
The molecular weight of N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide is 308.01 g/mol.
Where can I buy N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide?
You can request a quote for N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzothiazol-2-yl)-4-fluorobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.