3-(2,4-Dioxo-5-o-tolylamino-thiazolidin-3-yl)-propionic acid
TL;DR: 3-(2,4-Dioxo-5-o-tolylamino-thiazolidin-3-yl)-propionic acid (CAS 1008695-64-4) is a chemical compound with molecular formula C13H14N2O4S and molecular weight 294.0674 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[5-(2-methylanilino)-2,4-dioxo-1,3-thiazolidin-3-yl]propanoic acid
Also Known As: BAS 06262494, 3-(2,4-Dioxo-5-o-tolylamino-thiazolidin-3-yl)-propionic acid, 3-{5-[(2-methylphenyl)amino]-2,4-dioxo-1,3-thiazolidin-3-yl}propanoic acid, 3-(2,4-dioxo-5-(o-tolylamino)thiazolidin-3-yl)propanoic acid, 3-[5-(2-methylanilino)-2,4-dioxo-1,3-thiazolidin-3-yl]propanoic acid
Technical Specifications
| Molecular Formula | C13H14N2O4S |
| Molecular Weight | 294.0674 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 294.0674 Da |
| Heavy Atoms | 20 |
| Complexity | 415.0 |
| SMILES | CC1=CC=CC=C1NC2C(=O)N(C(=O)S2)CCC(=O)O |
| InChIKey | DABUJMAYSONSHC-UHFFFAOYSA-N |
Chemical Property Profile of 3-(2,4-Dioxo-5-o-tolylamino-thiazolidin-3-yl)-propionic acid
Property Insights of 3-(2,4-Dioxo-5-o-tolylamino-thiazolidin-3-yl)-propionic acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2,4-Dioxo-5-o-tolylamino-thiazolidin-3-yl)-propionic acid. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2,4-Dioxo-5-o-tolylamino-thiazolidin-3-yl)-propionic acid. Following Lipinski's Rule of Five, 3-(2,4-Dioxo-5-o-tolylamino-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-(2,4-Dioxo-5-o-tolylamino-thiazolidin-3-yl)-propionic acid?
The CAS number of 3-(2,4-Dioxo-5-o-tolylamino-thiazolidin-3-yl)-propionic acid is 1008695-64-4.
What is the molecular formula of 3-(2,4-Dioxo-5-o-tolylamino-thiazolidin-3-yl)-propionic acid?
The molecular formula of 3-(2,4-Dioxo-5-o-tolylamino-thiazolidin-3-yl)-propionic acid is C13H14N2O4S.
What is the molecular weight of 3-(2,4-Dioxo-5-o-tolylamino-thiazolidin-3-yl)-propionic acid?
The molecular weight of 3-(2,4-Dioxo-5-o-tolylamino-thiazolidin-3-yl)-propionic acid is 294.0674 g/mol.
Where can I buy 3-(2,4-Dioxo-5-o-tolylamino-thiazolidin-3-yl)-propionic acid?
You can request a quote for 3-(2,4-Dioxo-5-o-tolylamino-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-(2,4-Dioxo-5-o-tolylamino-thiazolidin-3-yl)-propionic acid?
Yes, CoreyChem provides custom synthesis services for 3-(2,4-Dioxo-5-o-tolylamino-thiazolidin-3-yl)-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.