![3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid structure](/static/products/1009/1009666-72-1.webp)
3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid
TL;DR: 3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid (CAS 1009666-72-1) is a chemical compound with molecular formula C12H11ClN2O4S and molecular weight 314.01282 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[5-(4-chloroanilino)-2,4-dioxo-1,3-thiazolidin-3-yl]propanoic acid
Also Known As: BAS 06262488, 3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid, 3-[5-(4-chloroanilino)-2,4-dioxo-1,3-thiazolidin-3-yl]propanoic acid, AT-057/41290239, 3-(5-((4-chlorophenyl)amino)-2,4-dioxothiazolidin-3-yl)propanoic acid
Technical Specifications
| Molecular Formula | C12H11ClN2O4S |
| Molecular Weight | 314.01282 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 314.01282 Da |
| Heavy Atoms | 20 |
| Complexity | 412.0 |
| SMILES | C1=CC(=CC=C1NC2C(=O)N(C(=O)S2)CCC(=O)O)Cl |
| InChIKey | AYBCGDRCUYIRES-UHFFFAOYSA-N |
Chemical Property Profile of 3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid
Property Insights of 3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid. Following Lipinski's Rule of Five, 3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid?
The CAS number of 3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid is 1009666-72-1.
What is the molecular formula of 3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid?
The molecular formula of 3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid is C12H11ClN2O4S.
What is the molecular weight of 3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid?
The molecular weight of 3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid is 314.01282 g/mol.
Where can I buy 3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid?
You can request a quote for 3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid?
Yes, CoreyChem provides custom synthesis services for 3-[5-(4-Chloro-phenylamino)-2,4-dioxo-thiazolidin-3-yl]-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.