(2S)-2-(3-Chlorobenzenesulfonamido)-3-methylbutanoic acid
TL;DR: (2S)-2-(3-Chlorobenzenesulfonamido)-3-methylbutanoic acid (CAS 1009549-57-8) is a chemical compound with molecular formula C11H14ClNO4S and molecular weight 291.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methylbutanoic acid
Also Known As: ((3-chlorophenyl)sulfonyl)valine, (2S)-2-(3-CHLOROBENZENESULFONAMIDO)-3-METHYLBUTANOIC ACID, (2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methylbutanoic acid, (2S)-2-{[(3-chlorophenyl)sulfonyl]amino}-3-methylbutanoic acid, 2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butanoic Acid
| Molecular Formula | C11H14ClNO4S |
|---|---|
| Molecular Weight | 291.03 g/mol |
| LogP | 1.7275 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 291.0332 |
| Heavy Atoms | 18 |
| Complexity | 541.7291 |
Chemical Identifiers
| CAS Number | 1009549-57-8 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)O)NS(=O)(=O)C1=CC(=CC=C1)Cl |
Product Overview
(2S)-2-(3-Chlorobenzenesulfonamido)-3-methylbutanoic acid (CAS 1009549-57-8), with molecular formula C11H14ClNO4S and molecular weight 291.03 g/mol. IUPAC: (2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methylbutanoic acid.
Chemical Property Profile of (2S)-2-(3-Chlorobenzenesulfonamido)-3-methylbutanoic acid
Property Insights of (2S)-2-(3-Chlorobenzenesulfonamido)-3-methylbutanoic acid
The XLogP value of 1.7275 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-2-(3-Chlorobenzenesulfonamido)-3-methylbutanoic acid. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-(3-Chlorobenzenesulfonamido)-3-methylbutanoic acid. Following Lipinski's Rule of Five, (2S)-2-(3-Chlorobenzenesulfonamido)-3-methylbutanoic 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 (2S)-2-(3-Chlorobenzenesulfonamido)-3-methylbutanoic acid?
The CAS number of (2S)-2-(3-Chlorobenzenesulfonamido)-3-methylbutanoic acid is 1009549-57-8.
What is the molecular formula of (2S)-2-(3-Chlorobenzenesulfonamido)-3-methylbutanoic acid?
The molecular formula of (2S)-2-(3-Chlorobenzenesulfonamido)-3-methylbutanoic acid is C11H14ClNO4S.
What is the molecular weight of (2S)-2-(3-Chlorobenzenesulfonamido)-3-methylbutanoic acid?
The molecular weight of (2S)-2-(3-Chlorobenzenesulfonamido)-3-methylbutanoic acid is 291.03 g/mol.
Where can I buy (2S)-2-(3-Chlorobenzenesulfonamido)-3-methylbutanoic acid?
You can request a quote for (2S)-2-(3-Chlorobenzenesulfonamido)-3-methylbutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-(3-Chlorobenzenesulfonamido)-3-methylbutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-(3-Chlorobenzenesulfonamido)-3-methylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.