2-(3-Methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid
TL;DR: 2-(3-Methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid (CAS 56784-39-5) is a chemical compound with molecular formula C11H16N2O3S and molecular weight 256.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid
Also Known As: Ozolinone, (S)-1-Boc-3-fluoropyrrolidine, Acetic acid, [3-methyl-4-oxo-5-(1-piperidinyl)-2-thiazolidinylidene]-
| Molecular Formula | C11H16N2O3S |
|---|---|
| Molecular Weight | 256.09 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 86.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.08817 |
| Heavy Atoms | 17 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 56784-39-5 |
|---|---|
| SMILES | CN1C(=CC(=O)O)SC(C1=O)N2CCCCC2 |
| InChIKey | NQFBZYYUAFJYNS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(3-Methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid (CAS 56784-39-5), with molecular formula C11H16N2O3S and molecular weight 256.09 g/mol. IUPAC: 2-(3-methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid.
Chemical Property Profile of 2-(3-Methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid
Property Insights of 2-(3-Methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid
The XLogP value of -1.4 indicates that 2-(3-Methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid. Following Lipinski's Rule of Five, 2-(3-Methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid 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 2-(3-Methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid?
The CAS number of 2-(3-Methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid is 56784-39-5.
What is the molecular formula of 2-(3-Methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid?
The molecular formula of 2-(3-Methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid is C11H16N2O3S.
What is the molecular weight of 2-(3-Methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid?
The molecular weight of 2-(3-Methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid is 256.09 g/mol.
Where can I buy 2-(3-Methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid?
You can request a quote for 2-(3-Methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.