6-(Methyl(phenylsulfonyl)amino)hexanoic acid
TL;DR: 6-(Methyl(phenylsulfonyl)amino)hexanoic acid (CAS 46948-72-5) is a chemical compound with molecular formula C13H19NO4S and molecular weight 285.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[benzenesulfonyl(methyl)amino]hexanoic acid
Also Known As: HOSTACOR H, 6-[methyl(phenylsulfonyl)amino]hexanoic acid, Hexanoic acid, 6-[methyl(phenylsulfonyl)amino]-, 6-(N-Methylphenylsulfonamido)hexanoic acid, 6-[benzenesulfonyl(methyl)amino]hexanoic acid
| Molecular Formula | C13H19NO4S |
|---|---|
| Molecular Weight | 285.10 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 285.1035 |
| Heavy Atoms | 19 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 46948-72-5 |
|---|---|
| SMILES | CN(CCCCCC(=O)O)S(=O)(=O)C1=CC=CC=C1 |
| InChIKey | ASJPRZHJNRBKTI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-(Methyl(phenylsulfonyl)amino)hexanoic acid (CAS 46948-72-5), with molecular formula C13H19NO4S and molecular weight 285.10 g/mol. IUPAC: 6-[benzenesulfonyl(methyl)amino]hexanoic acid.
Chemical Property Profile of 6-(Methyl(phenylsulfonyl)amino)hexanoic acid
Property Insights of 6-(Methyl(phenylsulfonyl)amino)hexanoic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(Methyl(phenylsulfonyl)amino)hexanoic acid. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(Methyl(phenylsulfonyl)amino)hexanoic acid. Following Lipinski's Rule of Five, 6-(Methyl(phenylsulfonyl)amino)hexanoic 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 6-(Methyl(phenylsulfonyl)amino)hexanoic acid?
The CAS number of 6-(Methyl(phenylsulfonyl)amino)hexanoic acid is 46948-72-5.
What is the molecular formula of 6-(Methyl(phenylsulfonyl)amino)hexanoic acid?
The molecular formula of 6-(Methyl(phenylsulfonyl)amino)hexanoic acid is C13H19NO4S.
What is the molecular weight of 6-(Methyl(phenylsulfonyl)amino)hexanoic acid?
The molecular weight of 6-(Methyl(phenylsulfonyl)amino)hexanoic acid is 285.10 g/mol.
Where can I buy 6-(Methyl(phenylsulfonyl)amino)hexanoic acid?
You can request a quote for 6-(Methyl(phenylsulfonyl)amino)hexanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(Methyl(phenylsulfonyl)amino)hexanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-(Methyl(phenylsulfonyl)amino)hexanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.