3-(4-Methylphenyl)-5-(4-toluidinomethylene)-1lambda~6~,3-thiazolane-1,1,4-trione
TL;DR: 3-(4-Methylphenyl)-5-(4-toluidinomethylene)-1lambda~6~,3-thiazolane-1,1,4-trione (CAS 338753-42-7) is a chemical compound with molecular formula C18H18N2O3S and molecular weight 342.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(4-methylanilino)methylidene]-3-(4-methylphenyl)-1,1-dioxo-1,3-thiazolidin-4-one
Also Known As: 5D-162, (5E)-5-[(4-methylanilino)methylidene]-3-(4-methylphenyl)-1,1-dioxo-1,3-thiazolidin-4-one, 3-(4-methylphenyl)-5-(4-toluidinomethylene)-1lambda~6~,3-thiazolane-1,1,4-trione, 3-(4-methylphenyl)-5-[[(4-methylphenyl)amino]methylidene]-1,1-dioxo-1,3-thiazolidin-4-one, (5E)-3-(4-methylphenyl)-5-{[(4-methylphenyl)amino]methylidene}-1lambda6,3-thiazolidine-1,1,4-trione
| Molecular Formula | C18H18N2O3S |
|---|---|
| Molecular Weight | 342.10 g/mol |
| LogP | 2.97584 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 342.10382 |
| Heavy Atoms | 24 |
| Complexity | 898.285 |
Chemical Identifiers
| CAS Number | 338753-42-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N/C=C/2\C(=O)N(CS2(=O)=O)C3=CC=C(C=C3)C |
Product Overview
3-(4-Methylphenyl)-5-(4-toluidinomethylene)-1lambda~6~,3-thiazolane-1,1,4-trione (CAS 338753-42-7), with molecular formula C18H18N2O3S and molecular weight 342.10 g/mol. IUPAC: (5E)-5-[(4-methylanilino)methylidene]-3-(4-methylphenyl)-1,1-dioxo-1,3-thiazolidin-4-one.
Chemical Property Profile of 3-(4-Methylphenyl)-5-(4-toluidinomethylene)-1lambda~6~,3-thiazolane-1,1,4-trione
Property Insights of 3-(4-Methylphenyl)-5-(4-toluidinomethylene)-1lambda~6~,3-thiazolane-1,1,4-trione
The XLogP value of 2.97584 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Methylphenyl)-5-(4-toluidinomethylene)-1lambda~6~,3-thiazolane-1,1,4-trione. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Methylphenyl)-5-(4-toluidinomethylene)-1lambda~6~,3-thiazolane-1,1,4-trione. Following Lipinski's Rule of Five, 3-(4-Methylphenyl)-5-(4-toluidinomethylene)-1lambda~6~,3-thiazolane-1,1,4-trione 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 3-(4-Methylphenyl)-5-(4-toluidinomethylene)-1lambda~6~,3-thiazolane-1,1,4-trione?
The CAS number of 3-(4-Methylphenyl)-5-(4-toluidinomethylene)-1lambda~6~,3-thiazolane-1,1,4-trione is 338753-42-7.
What is the molecular formula of 3-(4-Methylphenyl)-5-(4-toluidinomethylene)-1lambda~6~,3-thiazolane-1,1,4-trione?
The molecular formula of 3-(4-Methylphenyl)-5-(4-toluidinomethylene)-1lambda~6~,3-thiazolane-1,1,4-trione is C18H18N2O3S.
What is the molecular weight of 3-(4-Methylphenyl)-5-(4-toluidinomethylene)-1lambda~6~,3-thiazolane-1,1,4-trione?
The molecular weight of 3-(4-Methylphenyl)-5-(4-toluidinomethylene)-1lambda~6~,3-thiazolane-1,1,4-trione is 342.10 g/mol.
Where can I buy 3-(4-Methylphenyl)-5-(4-toluidinomethylene)-1lambda~6~,3-thiazolane-1,1,4-trione?
You can request a quote for 3-(4-Methylphenyl)-5-(4-toluidinomethylene)-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-Methylphenyl)-5-(4-toluidinomethylene)-1lambda~6~,3-thiazolane-1,1,4-trione?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Methylphenyl)-5-(4-toluidinomethylene)-1lambda~6~,3-thiazolane-1,1,4-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.