2-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid
TL;DR: 2-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid (CAS 64527-23-7) is a chemical compound with molecular formula C12H16N2O6S and molecular weight 316.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R)-2-[(4-acetamidophenyl)sulfonylamino]-3-hydroxybutanoic acid
Also Known As: BAS 02235596, N-(4-Acetamidobenzene-1-sulfonyl)-L-threonine, Threonine, N-[[4-(acetylamino)phenyl]sulfonyl]-, 2-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid, (2S,3R)-2-[(4-acetamidophenyl)sulfonylamino]-3-hydroxybutanoic acid
| Molecular Formula | C12H16N2O6S |
|---|---|
| Molecular Weight | 316.07 g/mol |
| LogP | -0.2427 |
| Topological Polar Surface Area | 132.8 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 316.0729 |
| Heavy Atoms | 21 |
| Complexity | 623.65265 |
Chemical Identifiers
| CAS Number | 64527-23-7 |
|---|---|
| SMILES | C[C@H]([C@@H](C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C)O |
Product Overview
2-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid (CAS 64527-23-7), with molecular formula C12H16N2O6S and molecular weight 316.07 g/mol. IUPAC: (2S,3R)-2-[(4-acetamidophenyl)sulfonylamino]-3-hydroxybutanoic acid.
Chemical Property Profile of 2-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid
Property Insights of 2-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid
The XLogP value of -0.2427 indicates that 2-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 132.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid. Following Lipinski's Rule of Five, 2-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid has 4 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-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid?
The CAS number of 2-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid is 64527-23-7.
What is the molecular formula of 2-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid?
The molecular formula of 2-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid is C12H16N2O6S.
What is the molecular weight of 2-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid?
The molecular weight of 2-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid is 316.07 g/mol.
Where can I buy 2-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid?
You can request a quote for 2-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Acetylamino-benzenesulfonylamino)-3-hydroxy-butyric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.