3-Acetyl-2-phenyl-4-thiazolidinecarboxylic acid
TL;DR: 3-Acetyl-2-phenyl-4-thiazolidinecarboxylic acid (CAS 294845-27-5) is a chemical compound with molecular formula C12H13NO3S and molecular weight 251.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetyl-2-phenyl-1,3-thiazolidine-4-carboxylic acid
Also Known As: 3-ACETYL-2-PHENYL-4-THIAZOLIDINECARBOXYLIC ACID, 3-Acetyl-2-phenyl-1,3-thiazolidine-4-carboxylic acid, 3-Acetyl-2-phenyl-thiazolidine-4-carboxylic acid, 3-acetyl-2-phenylthiazolidine-4-carboxylic acid, N-acetyl-2-phenyl-4-carboxy-1,3-thiazolidine
| Molecular Formula | C12H13NO3S |
|---|---|
| Molecular Weight | 251.06 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 82.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.06161 |
| Heavy Atoms | 17 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 294845-27-5 |
|---|---|
| SMILES | CC(=O)N1C(CSC1C2=CC=CC=C2)C(=O)O |
| InChIKey | NYATUQLQYZIJCY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Acetyl-2-phenyl-4-thiazolidinecarboxylic acid (CAS 294845-27-5), with molecular formula C12H13NO3S and molecular weight 251.06 g/mol. IUPAC: 3-acetyl-2-phenyl-1,3-thiazolidine-4-carboxylic acid.
Chemical Property Profile of 3-Acetyl-2-phenyl-4-thiazolidinecarboxylic acid
Property Insights of 3-Acetyl-2-phenyl-4-thiazolidinecarboxylic acid
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Acetyl-2-phenyl-4-thiazolidinecarboxylic acid. The TPSA of 82.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Acetyl-2-phenyl-4-thiazolidinecarboxylic acid. Following Lipinski's Rule of Five, 3-Acetyl-2-phenyl-4-thiazolidinecarboxylic acid 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 3-Acetyl-2-phenyl-4-thiazolidinecarboxylic acid?
The CAS number of 3-Acetyl-2-phenyl-4-thiazolidinecarboxylic acid is 294845-27-5.
What is the molecular formula of 3-Acetyl-2-phenyl-4-thiazolidinecarboxylic acid?
The molecular formula of 3-Acetyl-2-phenyl-4-thiazolidinecarboxylic acid is C12H13NO3S.
What is the molecular weight of 3-Acetyl-2-phenyl-4-thiazolidinecarboxylic acid?
The molecular weight of 3-Acetyl-2-phenyl-4-thiazolidinecarboxylic acid is 251.06 g/mol.
Where can I buy 3-Acetyl-2-phenyl-4-thiazolidinecarboxylic acid?
You can request a quote for 3-Acetyl-2-phenyl-4-thiazolidinecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Acetyl-2-phenyl-4-thiazolidinecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Acetyl-2-phenyl-4-thiazolidinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.