![3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo- structure](/static/products/2994/29947-14-6.webp)
3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo-
TL;DR: 3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo- (CAS 29947-14-6) is a chemical compound with molecular formula C13H9NO5S2 and molecular weight 322.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[3-(carboxymethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid
Also Known As: 3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo-, 4-[[3-(carboxymethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-, 4-[[3-(carboxymethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid
| Molecular Formula | C13H9NO5S2 |
|---|---|
| Molecular Weight | 322.99 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 152.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 322.99222 |
| Heavy Atoms | 21 |
| Complexity | 523.0 |
Chemical Identifiers
| CAS Number | 29947-14-6 |
|---|---|
| SMILES | C1=CC(=CC=C1C=C2C(=O)N(C(=S)S2)CC(=O)O)C(=O)O |
| InChIKey | RARMXMDEVBVFSN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo- (CAS 29947-14-6), with molecular formula C13H9NO5S2 and molecular weight 322.99 g/mol. IUPAC: 4-[[3-(carboxymethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid.
Chemical Property Profile of 3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo-
Property Insights of 3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo-. The TPSA of 152.0 Ų indicates high polarity, suggesting 3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo- has 2 hydrogen bond donor(s) and 7 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-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo-?
The CAS number of 3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo- is 29947-14-6.
What is the molecular formula of 3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo-?
The molecular formula of 3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo- is C13H9NO5S2.
What is the molecular weight of 3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo-?
The molecular weight of 3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo- is 322.99 g/mol.
Where can I buy 3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo-?
You can request a quote for 3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo-?
Yes, KEHONG BIO provides custom synthesis services for 3-Thiazolidineaceticacid, 5-[(4-carboxyphenyl)methylene]-4-oxo-2-thioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.