2-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate
TL;DR: 2-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate (CAS 747397-66-6) is a chemical compound with molecular formula C17H20N2O4S2 and molecular weight 380.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylamino)ethyl 2-[5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetate
Also Known As: 2-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate, 2-(Dimethylamino)ethyl {5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetate, 2-dimethylaminoethyl 2-[5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetate
| Molecular Formula | C17H20N2O4S2 |
|---|---|
| Molecular Weight | 380.09 g/mol |
| LogP | 2.0012 |
| Topological Polar Surface Area | 59.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 380.08646 |
| Heavy Atoms | 25 |
| Complexity | 686.3932 |
Chemical Identifiers
| CAS Number | 747397-66-6 |
|---|---|
| SMILES | CN(C)CCOC(=O)CN1C(=O)C(=CC2=CC=C(C=C2)OC)SC1=S |
Product Overview
2-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate (CAS 747397-66-6), with molecular formula C17H20N2O4S2 and molecular weight 380.09 g/mol. IUPAC: 2-(dimethylamino)ethyl 2-[5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetate.
Chemical Property Profile of 2-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate
Property Insights of 2-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate
The XLogP value of 2.0012 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate. With a topological polar surface area (TPSA) of 59.08 Ų, 2-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate has 0 hydrogen bond donor(s) and 7 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-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate?
The CAS number of 2-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate is 747397-66-6.
What is the molecular formula of 2-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate?
The molecular formula of 2-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate is C17H20N2O4S2.
What is the molecular weight of 2-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate?
The molecular weight of 2-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate is 380.09 g/mol.
Where can I buy 2-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate?
You can request a quote for 2-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Dimethylamino)ethyl 5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidineacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.