5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo-
TL;DR: 5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo- (CAS 4891-93-4) is a chemical compound with molecular formula C11H9NO3S2 and molecular weight 267.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-yl)acetic acid
Also Known As: 5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo-, 5-Thiazolidineaceticacid,4-oxo-3-phenyl-2-thioxo, 2-(4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-yl)acetic acid, (4-OXO-3-PHENYL-2-SULFANYLIDENE-1,3-THIAZOLIDIN-5-YL)ACETIC ACID
| Molecular Formula | C11H9NO3S2 |
|---|---|
| Molecular Weight | 267.00 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.00238 |
| Heavy Atoms | 17 |
| Complexity | 353.0 |
Chemical Identifiers
| CAS Number | 4891-93-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)C(SC2=S)CC(=O)O |
| InChIKey | GZCLPYCDOGGRSC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo- (CAS 4891-93-4), with molecular formula C11H9NO3S2 and molecular weight 267.00 g/mol. IUPAC: 2-(4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-yl)acetic acid.
Chemical Property Profile of 5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo-
Property Insights of 5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo-
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo-. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo-. Following Lipinski's Rule of Five, 5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo- has 1 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 5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo-?
The CAS number of 5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo- is 4891-93-4.
What is the molecular formula of 5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo-?
The molecular formula of 5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo- is C11H9NO3S2.
What is the molecular weight of 5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo-?
The molecular weight of 5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo- is 267.00 g/mol.
Where can I buy 5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo-?
You can request a quote for 5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo-?
Yes, KEHONG BIO provides custom synthesis services for 5-Thiazolidineaceticacid, 4-oxo-3-phenyl-2-thioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.