(E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid
TL;DR: (E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid (CAS 902309-08-4) is a chemical compound with molecular formula C18H20N2O5S2 and molecular weight 408.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoyl]piperidine-4-carboxylic acid
Also Known As: (E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid, 1-[4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoyl]piperidine-4-carboxylic acid, 1-{4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}piperidine-4-carboxylic acid
| Molecular Formula | C18H20N2O5S2 |
|---|---|
| Molecular Weight | 408.08 g/mol |
| LogP | 2.5842 |
| Topological Polar Surface Area | 91.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 408.08136 |
| Heavy Atoms | 27 |
| Complexity | 766.72473 |
Chemical Identifiers
| CAS Number | 902309-08-4 |
|---|---|
| SMILES | C1CN(CCC1C(=O)O)C(=O)CCCN2C(=O)/C(=C\C3=CC=CO3)/SC2=S |
Product Overview
(E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid (CAS 902309-08-4), with molecular formula C18H20N2O5S2 and molecular weight 408.08 g/mol. IUPAC: 1-[4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoyl]piperidine-4-carboxylic acid.
Chemical Property Profile of (E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid
Property Insights of (E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid
The XLogP value of 2.5842 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid. The TPSA of 91.06 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid. Following Lipinski's Rule of Five, (E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid has 1 hydrogen bond donor(s) and 6 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 (E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid?
The CAS number of (E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid is 902309-08-4.
What is the molecular formula of (E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid?
The molecular formula of (E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid is C18H20N2O5S2.
What is the molecular weight of (E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid?
The molecular weight of (E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid is 408.08 g/mol.
Where can I buy (E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid?
You can request a quote for (E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for (E)-1-(4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoyl)piperidine-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.