5-(Methylsulfonyl)nicotinic acid
TL;DR: 5-(Methylsulfonyl)nicotinic acid (CAS 30129-18-1) is a chemical compound with molecular formula C7H7NO4S and molecular weight 201.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methylsulfonylpyridine-3-carboxylic acid
Also Known As: 5-(METHYLSULFONYL)NICOTINIC ACID, 5-methylsulfonylpyridine-3-carboxylic Acid, Methyl11-Bromoundecanoate, 5-(Methylsulfonyl)nicotinicAcid, 5-METHANESULFONYLPYRIDINE-3-CARBOXYLIC ACID
| Molecular Formula | C7H7NO4S |
|---|---|
| Molecular Weight | 201.01 g/mol |
| LogP | 0.1833 |
| Topological Polar Surface Area | 84.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 201.00958 |
| Heavy Atoms | 13 |
| Complexity | 437.5607 |
Chemical Identifiers
| CAS Number | 30129-18-1 |
|---|---|
| SMILES | CS(=O)(=O)C1=CN=CC(=C1)C(=O)O |
Product Overview
5-(Methylsulfonyl)nicotinic acid (CAS 30129-18-1), with molecular formula C7H7NO4S and molecular weight 201.01 g/mol. IUPAC: 5-methylsulfonylpyridine-3-carboxylic acid.
Chemical Property Profile of 5-(Methylsulfonyl)nicotinic acid
Property Insights of 5-(Methylsulfonyl)nicotinic acid
The XLogP value of 0.1833 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Methylsulfonyl)nicotinic acid. The TPSA of 84.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Methylsulfonyl)nicotinic acid. Following Lipinski's Rule of Five, 5-(Methylsulfonyl)nicotinic acid 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 5-(Methylsulfonyl)nicotinic acid?
The CAS number of 5-(Methylsulfonyl)nicotinic acid is 30129-18-1.
What is the molecular formula of 5-(Methylsulfonyl)nicotinic acid?
The molecular formula of 5-(Methylsulfonyl)nicotinic acid is C7H7NO4S.
What is the molecular weight of 5-(Methylsulfonyl)nicotinic acid?
The molecular weight of 5-(Methylsulfonyl)nicotinic acid is 201.01 g/mol.
Where can I buy 5-(Methylsulfonyl)nicotinic acid?
You can request a quote for 5-(Methylsulfonyl)nicotinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Methylsulfonyl)nicotinic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(Methylsulfonyl)nicotinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.