(E)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione
TL;DR: (E)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione (CAS 488731-36-8) is a chemical compound with molecular formula C18H14N2O4S and molecular weight 354.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-3-[(4-methylphenyl)methyl]-5-[(3-nitrophenyl)methylidene]-1,3-thiazolidine-2,4-dione
Also Known As: (E)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione, (5E)-3-[(4-methylphenyl)methyl]-5-[(3-nitrophenyl)methylidene]-1,3-thiazolidine-2,4-dione, 3-[(4-methylphenyl)methyl]-5-[(3-nitrophenyl)methylene]-1,3-thiazolidine-2,4-d ione
| Molecular Formula | C18H14N2O4S |
|---|---|
| Molecular Weight | 354.07 g/mol |
| LogP | 4.13972 |
| Topological Polar Surface Area | 80.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 354.0674 |
| Heavy Atoms | 25 |
| Complexity | 890.204 |
Chemical Identifiers
| CAS Number | 488731-36-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C(=O)/C(=C\C3=CC(=CC=C3)[N+](=O)[O-])/SC2=O |
Product Overview
(E)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione (CAS 488731-36-8), with molecular formula C18H14N2O4S and molecular weight 354.07 g/mol. IUPAC: (5E)-3-[(4-methylphenyl)methyl]-5-[(3-nitrophenyl)methylidene]-1,3-thiazolidine-2,4-dione.
Chemical Property Profile of (E)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione
Property Insights of (E)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione
The XLogP value of 4.13972 indicates that (E)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.52 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione. Following Lipinski's Rule of Five, (E)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione has 0 hydrogen bond donor(s) and 5 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)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione?
The CAS number of (E)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione is 488731-36-8.
What is the molecular formula of (E)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione?
The molecular formula of (E)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione is C18H14N2O4S.
What is the molecular weight of (E)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione?
The molecular weight of (E)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione is 354.07 g/mol.
Where can I buy (E)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione?
You can request a quote for (E)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(4-methylbenzyl)-5-(3-nitrobenzylidene)thiazolidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.