4-Hydroxy-1,2,5-Thiadiazole-3-Carboxylic Acid
TL;DR: 4-Hydroxy-1,2,5-Thiadiazole-3-Carboxylic Acid (CAS 45654-48-6) is a chemical compound with molecular formula C3H2N2O3S and molecular weight 145.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-1,2,5-thiadiazole-3-carboxylic acid
Also Known As: LDHA Inhibitor, 1, 4-HYDROXY-1,2,5-THIADIAZOLE-3-CARBOXYLIC ACID, 1,2,5-Thiadiazole, TDA1, 4-oxo-1,2,5-thiadiazole-3-carboxylic acid, 3-Hydroxy-1,2,5-thiadiazol-carbonsaeure
| Molecular Formula | C3H2N2O3S |
|---|---|
| Molecular Weight | 145.98 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 145.9786 |
| Heavy Atoms | 9 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 45654-48-6 |
|---|---|
| SMILES | C1(=NSNC1=O)C(=O)O |
| InChIKey | FVZITYNLUYJDOE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Hydroxy-1,2,5-Thiadiazole-3-Carboxylic Acid (CAS 45654-48-6), with molecular formula C3H2N2O3S and molecular weight 145.98 g/mol. IUPAC: 4-oxo-1,2,5-thiadiazole-3-carboxylic acid.
Chemical Property Profile of 4-Hydroxy-1,2,5-Thiadiazole-3-Carboxylic Acid
Property Insights of 4-Hydroxy-1,2,5-Thiadiazole-3-Carboxylic Acid
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxy-1,2,5-Thiadiazole-3-Carboxylic Acid. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Hydroxy-1,2,5-Thiadiazole-3-Carboxylic Acid. Following Lipinski's Rule of Five, 4-Hydroxy-1,2,5-Thiadiazole-3-Carboxylic Acid has 2 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 4-Hydroxy-1,2,5-Thiadiazole-3-Carboxylic Acid?
The CAS number of 4-Hydroxy-1,2,5-Thiadiazole-3-Carboxylic Acid is 45654-48-6.
What is the molecular formula of 4-Hydroxy-1,2,5-Thiadiazole-3-Carboxylic Acid?
The molecular formula of 4-Hydroxy-1,2,5-Thiadiazole-3-Carboxylic Acid is C3H2N2O3S.
What is the molecular weight of 4-Hydroxy-1,2,5-Thiadiazole-3-Carboxylic Acid?
The molecular weight of 4-Hydroxy-1,2,5-Thiadiazole-3-Carboxylic Acid is 145.98 g/mol.
Where can I buy 4-Hydroxy-1,2,5-Thiadiazole-3-Carboxylic Acid?
You can request a quote for 4-Hydroxy-1,2,5-Thiadiazole-3-Carboxylic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxy-1,2,5-Thiadiazole-3-Carboxylic Acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxy-1,2,5-Thiadiazole-3-Carboxylic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.