![2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid structure](/static/products/1752/175203-21-1.webp)
2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid
TL;DR: 2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid (CAS 175203-21-1) is a chemical compound with molecular formula C14H13NO4S2 and molecular weight 323.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(benzenesulfonyl)ethylsulfanyl]pyridine-3-carboxylic acid
Also Known As: 2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid, Maybridge1_004978, 2-((2-(Phenylsulfonyl)ethyl)thio)nicotinic acid, 2-(2-(Phenylsulfonyl)ethylthio)nicotinic acid, 2-[2-(benzenesulfonyl)ethylsulfanyl]pyridine-3-carboxylic acid
| Molecular Formula | C14H13NO4S2 |
|---|---|
| Molecular Weight | 323.03 g/mol |
| LogP | 2.3458 |
| Topological Polar Surface Area | 84.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 323.0286 |
| Heavy Atoms | 21 |
| Complexity | 729.64905 |
Chemical Identifiers
| CAS Number | 175203-21-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)CCSC2=C(C=CC=N2)C(=O)O |
Product Overview
2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid (CAS 175203-21-1), with molecular formula C14H13NO4S2 and molecular weight 323.03 g/mol. IUPAC: 2-[2-(benzenesulfonyl)ethylsulfanyl]pyridine-3-carboxylic acid.
Chemical Property Profile of 2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid
Property Insights of 2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid
The XLogP value of 2.3458 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid. The TPSA of 84.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid. Following Lipinski's Rule of Five, 2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid 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 2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid?
The CAS number of 2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid is 175203-21-1.
What is the molecular formula of 2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid?
The molecular formula of 2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid is C14H13NO4S2.
What is the molecular weight of 2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid?
The molecular weight of 2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid is 323.03 g/mol.
Where can I buy 2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid?
You can request a quote for 2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(Phenylsulfonyl)ethylthio]nicotinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.