3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide
TL;DR: 3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide (CAS 833444-82-9) is a chemical compound with molecular formula C14H15FN2O3S and molecular weight 310.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide
Also Known As: 3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide, A3954/0168445, [(3-ethoxy-4-fluorophenyl)sulfonyl](4-pyridylmethyl)amine, Benzenesulfonamide, 3-ethoxy-4-fluoro-N-(4-pyridinylmethyl)-, 3-ethoxy-4-fluoro-N-[(pyridin-4-yl)methyl]benzene-1-sulfonamide
| Molecular Formula | C14H15FN2O3S |
|---|---|
| Molecular Weight | 310.08 g/mol |
| LogP | 2.0979 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 310.07874 |
| Heavy Atoms | 21 |
| Complexity | 705.414 |
Chemical Identifiers
| CAS Number | 833444-82-9 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)S(=O)(=O)NCC2=CC=NC=C2)F |
Product Overview
3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide (CAS 833444-82-9), with molecular formula C14H15FN2O3S and molecular weight 310.08 g/mol. IUPAC: 3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide.
Chemical Property Profile of 3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide
Property Insights of 3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide
The XLogP value of 2.0979 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide. Following Lipinski's Rule of Five, 3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide has 1 hydrogen bond donor(s) and 4 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 3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide?
The CAS number of 3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide is 833444-82-9.
What is the molecular formula of 3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide?
The molecular formula of 3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide is C14H15FN2O3S.
What is the molecular weight of 3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide?
The molecular weight of 3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide is 310.08 g/mol.
Where can I buy 3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide?
You can request a quote for 3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 3-ethoxy-4-fluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.