WS 1358A1
TL;DR: WS 1358A1 (CAS 13755-68-5) is a chemical compound with molecular formula C7H11NO7 and molecular weight 221.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-2-(hydroxycarbamoyl)-3-methylpentanedioic acid
Also Known As: WS 1358A1, WS-1358A1, 2-hydroxy-2-(hydroxycarbamoyl)-3-methylpentanedioic acid, FR 104007, J2.380.291K
| Molecular Formula | C7H11NO7 |
|---|---|
| Molecular Weight | 221.05 g/mol |
| LogP | -1.7 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 221.05356 |
| Heavy Atoms | 15 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 13755-68-5 |
|---|---|
| SMILES | CC(CC(=O)O)C(C(=O)NO)(C(=O)O)O |
| InChIKey | UKMWRYYABLDUMZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
WS 1358A1 (CAS 13755-68-5), with molecular formula C7H11NO7 and molecular weight 221.05 g/mol. IUPAC: 2-hydroxy-2-(hydroxycarbamoyl)-3-methylpentanedioic acid.
Chemical Property Profile of WS 1358A1
Property Insights of WS 1358A1
The XLogP value of -1.7 indicates that WS 1358A1 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 144.0 Ų indicates high polarity, suggesting WS 1358A1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, WS 1358A1 has 5 hydrogen bond donor(s) and 7 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 WS 1358A1?
The CAS number of WS 1358A1 is 13755-68-5.
What is the molecular formula of WS 1358A1?
The molecular formula of WS 1358A1 is C7H11NO7.
What is the molecular weight of WS 1358A1?
The molecular weight of WS 1358A1 is 221.05 g/mol.
Where can I buy WS 1358A1?
You can request a quote for WS 1358A1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for WS 1358A1?
Yes, KEHONG BIO provides custom synthesis services for WS 1358A1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.