![6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile structure](/static/products/3387/338774-50-8.webp)
6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile
TL;DR: 6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile (CAS 338774-50-8) is a chemical compound with molecular formula C13H8F3N3O3S and molecular weight 343.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-2-oxo-5-[3-(trifluoromethyl)phenyl]sulfonyl-1H-pyridine-3-carbonitrile
Also Known As: 2K-539S, 6-amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile, 6-amino-2-oxo-5-[3-(trifluoromethyl)phenyl]sulfonyl-1H-pyridine-3-carbonitrile, 6-Amino-2-hydroxy-5-((3-(trifluoromethyl)phenylsulfonyl)nicotinonitrile, 6-amino-2-hydroxy-5-[3-(trifluoromethyl)benzenesulfonyl]pyridine-3-carbonitrile
| Molecular Formula | C13H8F3N3O3S |
|---|---|
| Molecular Weight | 343.02 g/mol |
| LogP | 1.68038 |
| Topological Polar Surface Area | 116.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 343.02383 |
| Heavy Atoms | 23 |
| Complexity | 972.4251 |
Chemical Identifiers
| CAS Number | 338774-50-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)S(=O)(=O)C2=C(NC(=O)C(=C2)C#N)N)C(F)(F)F |
Product Overview
6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile (CAS 338774-50-8), with molecular formula C13H8F3N3O3S and molecular weight 343.02 g/mol. IUPAC: 6-amino-2-oxo-5-[3-(trifluoromethyl)phenyl]sulfonyl-1H-pyridine-3-carbonitrile.
Chemical Property Profile of 6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile
Property Insights of 6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile
The XLogP value of 1.68038 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile. The TPSA of 116.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile. Following Lipinski's Rule of Five, 6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile has 2 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 6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile?
The CAS number of 6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile is 338774-50-8.
What is the molecular formula of 6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile?
The molecular formula of 6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile is C13H8F3N3O3S.
What is the molecular weight of 6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile?
The molecular weight of 6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile is 343.02 g/mol.
Where can I buy 6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile?
You can request a quote for 6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Amino-2-hydroxy-5-{[3-(trifluoromethyl)phenyl]sulfonyl}nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.