Timonacic
TL;DR: Timonacic (CAS 444-27-9) is a chemical compound with molecular formula C4H7NO2S and molecular weight 133.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-thiazolidine-4-carboxylic acid
Also Known As: Timonacic, Thiazolidine-4-carboxylic acid, Thioproline, Detoxepa, Hepalidine
| Molecular Formula | C4H7NO2S |
|---|---|
| Molecular Weight | 133.02 g/mol |
| LogP | -2.3 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 133.01974 |
| Heavy Atoms | 8 |
| Complexity | 106.0 |
Chemical Identifiers
| CAS Number | 444-27-9 |
|---|---|
| SMILES | C1C(NCS1)C(=O)O |
| InChIKey | DZLNHFMRPBPULJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Timonacic (CAS 444-27-9), with molecular formula C4H7NO2S and molecular weight 133.02 g/mol. IUPAC: 1,3-thiazolidine-4-carboxylic acid.
Chemical Property Profile of Timonacic
Property Insights of Timonacic
The XLogP value of -2.3 indicates that Timonacic is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Timonacic. Following Lipinski's Rule of Five, Timonacic has 2 hydrogen bond donor(s) and 4 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 Timonacic?
The CAS number of Timonacic is 444-27-9.
What is the molecular formula of Timonacic?
The molecular formula of Timonacic is C4H7NO2S.
What is the molecular weight of Timonacic?
The molecular weight of Timonacic is 133.02 g/mol.
Where can I buy Timonacic?
You can request a quote for Timonacic directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Timonacic?
Yes, KEHONG BIO provides custom synthesis services for Timonacic and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.