Delta(2)-thiazoline-2-carboxylate
TL;DR: Delta(2)-thiazoline-2-carboxylate (CAS 85473-42-3) is a chemical compound with molecular formula C1CSC(=N1)C(=O)O and molecular weight 131.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dihydro-1,3-thiazole-2-carboxylic acid
Also Known As: DTZC, thiazolinecarboxylic acid, thiazoline carboxylic acid, 2-Thiazolecarboxylic acid, 4,5-dihydro-, delta(2)-Thiazoline-2-carboxylate
| Molecular Formula | C1CSC(=N1)C(=O)O |
|---|---|
| Molecular Weight | 131.00 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 75.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 131.0041 |
| Heavy Atoms | 8 |
| Complexity | 143.0 |
Chemical Identifiers
| CAS Number | 85473-42-3 |
|---|---|
| SMILES | C1CSC(=N1)C(=O)O |
| InChIKey | RFKAGFYMWORAGT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Delta(2)-thiazoline-2-carboxylate (CAS 85473-42-3), with molecular formula C1CSC(=N1)C(=O)O and molecular weight 131.00 g/mol. IUPAC: 4,5-dihydro-1,3-thiazole-2-carboxylic acid.
Chemical Property Profile of Delta(2)-thiazoline-2-carboxylate
Property Insights of Delta(2)-thiazoline-2-carboxylate
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Delta(2)-thiazoline-2-carboxylate. The TPSA of 75.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Delta(2)-thiazoline-2-carboxylate. Following Lipinski's Rule of Five, Delta(2)-thiazoline-2-carboxylate has 1 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 Delta(2)-thiazoline-2-carboxylate?
The CAS number of Delta(2)-thiazoline-2-carboxylate is 85473-42-3.
What is the molecular formula of Delta(2)-thiazoline-2-carboxylate?
The molecular formula of Delta(2)-thiazoline-2-carboxylate is C1CSC(=N1)C(=O)O.
What is the molecular weight of Delta(2)-thiazoline-2-carboxylate?
The molecular weight of Delta(2)-thiazoline-2-carboxylate is 131.00 g/mol.
Where can I buy Delta(2)-thiazoline-2-carboxylate?
You can request a quote for Delta(2)-thiazoline-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Delta(2)-thiazoline-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Delta(2)-thiazoline-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.