(3-((Methylsulfonyl)amino)phenyl)acetic acid
TL;DR: (3-((Methylsulfonyl)amino)phenyl)acetic acid (CAS 407640-28-2) is a chemical compound with molecular formula C9H11NO4S and molecular weight 229.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(methanesulfonamido)phenyl]acetic acid
Also Known As: 3-(methylsulphonylamino)phenylacetic acid, 2-(3-(Methylsulfonamido)phenyl)acetic acid, 2-[3-(methanesulfonamido)phenyl]acetic acid, 2-(3-methanesulfonamidophenyl)acetic Acid, (3-methanesulfonamidophenyl)acetic acid
| Molecular Formula | C9H11NO4S |
|---|---|
| Molecular Weight | 229.04 g/mol |
| LogP | 0.6852 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 229.04088 |
| Heavy Atoms | 15 |
| Complexity | 466.7556 |
Chemical Identifiers
| CAS Number | 407640-28-2 |
|---|---|
| SMILES | CS(=O)(=O)NC1=CC=CC(=C1)CC(=O)O |
Product Overview
(3-((Methylsulfonyl)amino)phenyl)acetic acid (CAS 407640-28-2), with molecular formula C9H11NO4S and molecular weight 229.04 g/mol. IUPAC: 2-[3-(methanesulfonamido)phenyl]acetic acid.
Chemical Property Profile of (3-((Methylsulfonyl)amino)phenyl)acetic acid
Property Insights of (3-((Methylsulfonyl)amino)phenyl)acetic acid
The XLogP value of 0.6852 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-((Methylsulfonyl)amino)phenyl)acetic acid. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-((Methylsulfonyl)amino)phenyl)acetic acid. Following Lipinski's Rule of Five, (3-((Methylsulfonyl)amino)phenyl)acetic acid has 2 hydrogen bond donor(s) and 3 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-((Methylsulfonyl)amino)phenyl)acetic acid?
The CAS number of (3-((Methylsulfonyl)amino)phenyl)acetic acid is 407640-28-2.
What is the molecular formula of (3-((Methylsulfonyl)amino)phenyl)acetic acid?
The molecular formula of (3-((Methylsulfonyl)amino)phenyl)acetic acid is C9H11NO4S.
What is the molecular weight of (3-((Methylsulfonyl)amino)phenyl)acetic acid?
The molecular weight of (3-((Methylsulfonyl)amino)phenyl)acetic acid is 229.04 g/mol.
Where can I buy (3-((Methylsulfonyl)amino)phenyl)acetic acid?
You can request a quote for (3-((Methylsulfonyl)amino)phenyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-((Methylsulfonyl)amino)phenyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (3-((Methylsulfonyl)amino)phenyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.