3-Acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid
TL;DR: 3-Acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid (CAS 294845-47-9) is a chemical compound with molecular formula C12H12BrNO3S and molecular weight 328.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid
Also Known As: BAS 00702370, 3-Acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid, 3-Acetyl-2-(4-bromo-phenyl)-thiazolidine-4-carboxylic acid, 3-Acetyl-2-(4-bromophenyl)thiazolidine-4-carboxylic acid, 3-Acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid #
| Molecular Formula | C12H12BrNO3S |
|---|---|
| Molecular Weight | 328.97 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 82.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.97214 |
| Heavy Atoms | 18 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 294845-47-9 |
|---|---|
| SMILES | CC(=O)N1C(CSC1C2=CC=C(C=C2)Br)C(=O)O |
| InChIKey | RQHDIPZZSXATDR-UHFFFAOYSA-N |
Product Overview
3-Acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid (CAS 294845-47-9), with molecular formula C12H12BrNO3S and molecular weight 328.97 g/mol. IUPAC: 3-acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid.
Chemical Property Profile of 3-Acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid
Property Insights of 3-Acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid. The TPSA of 82.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid. Following Lipinski's Rule of Five, 3-Acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic 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-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid?
The CAS number of 3-Acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid is 294845-47-9.
What is the molecular formula of 3-Acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid?
The molecular formula of 3-Acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid is C12H12BrNO3S.
What is the molecular weight of 3-Acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid?
The molecular weight of 3-Acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid is 328.97 g/mol.
Where can I buy 3-Acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid?
You can request a quote for 3-Acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic 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-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Acetyl-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.