![(5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one structure](/static/products/5855/585558-80-1.webp)
(5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one
TL;DR: (5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one (CAS 585558-80-1) is a chemical compound with molecular formula C13H13ClN2OS2 and molecular weight 312.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2-chlorophenyl)methyliminomethyl]-3-ethyl-4-hydroxy-1,3-thiazole-2-thione
Also Known As: (5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one, 5-[[(2-chlorophenyl)methylamino]methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one, (E)-5-(((2-chlorobenzyl)amino)methylene)-3-ethyl-2-thioxothiazolidin-4-one, 5-({[(2-chlorophenyl)methyl]amino}methylene)-3-ethyl-2-thioxo-1,3-thiazolidin- 4-one, (5E)-5-[[(2-chlorophenyl)methylamino]methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C13H13ClN2OS2 |
|---|---|
| Molecular Weight | 312.02 g/mol |
| LogP | 4.27709 |
| Topological Polar Surface Area | 37.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.01578 |
| Heavy Atoms | 19 |
| Complexity | 660.9031 |
Chemical Identifiers
| CAS Number | 585558-80-1 |
|---|---|
| SMILES | CCN1C(=C(SC1=S)C=NCC2=CC=CC=C2Cl)O |
Product Overview
(5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one (CAS 585558-80-1), with molecular formula C13H13ClN2OS2 and molecular weight 312.02 g/mol. IUPAC: 5-[(2-chlorophenyl)methyliminomethyl]-3-ethyl-4-hydroxy-1,3-thiazole-2-thione.
Chemical Property Profile of (5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one
Property Insights of (5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one
The XLogP value of 4.27709 indicates that (5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.52 Ų, (5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one has 1 hydrogen bond donor(s) and 4 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 (5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one?
The CAS number of (5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one is 585558-80-1.
What is the molecular formula of (5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one?
The molecular formula of (5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one is C13H13ClN2OS2.
What is the molecular weight of (5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one?
The molecular weight of (5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one is 312.02 g/mol.
Where can I buy (5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one?
You can request a quote for (5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-5-{[(2-chlorobenzyl)amino]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.