N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide
TL;DR: N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide (CAS 896269-00-4) is a chemical compound with molecular formula C15H11FN2O3S2 and molecular weight 350.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide
Also Known As: N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methanesulfonylbenzamide, F2556-0249, N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide, N-(4-fluoro-1,3-benzothiazol-2-yl)o-mesylbenzamide, N-(4-fluorobenzo[d]thiazol-2-yl)-2-(methylsulfonyl)benzamide
| Molecular Formula | C15H11FN2O3S2 |
|---|---|
| Molecular Weight | 350.02 g/mol |
| LogP | 3.0912 |
| Topological Polar Surface Area | 76.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 350.0195 |
| Heavy Atoms | 23 |
| Complexity | 1012.48883 |
Chemical Identifiers
| CAS Number | 896269-00-4 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC=CC=C1C(=O)NC2=NC3=C(C=CC=C3S2)F |
Product Overview
N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide (CAS 896269-00-4), with molecular formula C15H11FN2O3S2 and molecular weight 350.02 g/mol. IUPAC: N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide.
Chemical Property Profile of N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide
Property Insights of N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide
The XLogP value of 3.0912 indicates that N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.13 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide. Following Lipinski's Rule of Five, N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide 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-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide?
The CAS number of N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide is 896269-00-4.
What is the molecular formula of N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide?
The molecular formula of N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide is C15H11FN2O3S2.
What is the molecular weight of N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide?
The molecular weight of N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide is 350.02 g/mol.
Where can I buy N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide?
You can request a quote for N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-fluoro-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.