![3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione structure](/static/products/1164/1164563-90-9.webp)
3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione
TL;DR: 3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione (CAS 1164563-90-9) is a chemical compound with molecular formula C12H13ClN2O3S and molecular weight 300.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-3-(4-chlorophenyl)-5-(dimethylaminomethylidene)-1,1-dioxo-1,3-thiazolidin-4-one
Also Known As: 3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione, (5E)-3-(4-chlorophenyl)-5-(dimethylaminomethylidene)-1,1-dioxo-1,3-thiazolidin-4-one, (5E)-3-(4-chlorophenyl)-5-[(dimethylamino)methylidene]-1lambda6,3-thiazolidine-1,1,4-trione, 3-(4-Chlorophenyl)-5-[(dimethylamino)methylene]-3-thiazolane-1,1,4-trione, (5E)-3-(4-chlorophenyl)-5-(dimethylaminomethylene)-1,1-dioxo-1,3-thiazolidin-4-one
| Molecular Formula | C12H13ClN2O3S |
|---|---|
| Molecular Weight | 300.03 g/mol |
| LogP | 1.4619 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 300.03354 |
| Heavy Atoms | 19 |
| Complexity | 635.4433 |
Chemical Identifiers
| CAS Number | 1164563-90-9 |
|---|---|
| SMILES | CN(C)/C=C/1\C(=O)N(CS1(=O)=O)C2=CC=C(C=C2)Cl |
Product Overview
3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione (CAS 1164563-90-9), with molecular formula C12H13ClN2O3S and molecular weight 300.03 g/mol. IUPAC: (5E)-3-(4-chlorophenyl)-5-(dimethylaminomethylidene)-1,1-dioxo-1,3-thiazolidin-4-one.
Chemical Property Profile of 3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione
Property Insights of 3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione
The XLogP value of 1.4619 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione. With a topological polar surface area (TPSA) of 57.69 Ų, 3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione has 0 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 3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione?
The CAS number of 3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione is 1164563-90-9.
What is the molecular formula of 3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione?
The molecular formula of 3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione is C12H13ClN2O3S.
What is the molecular weight of 3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione?
The molecular weight of 3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione is 300.03 g/mol.
Where can I buy 3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione?
You can request a quote for 3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-chlorophenyl)-5-[(dimethylamino)methylene]-1lambda~6~,3-thiazolane-1,1,4-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.