(E)-5-benzylidene-3-butylthiazolidine-2,4-dione
TL;DR: (E)-5-benzylidene-3-butylthiazolidine-2,4-dione (CAS 5835-44-9) is a chemical compound with molecular formula C14H15NO2S and molecular weight 261.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-benzylidene-3-butyl-1,3-thiazolidine-2,4-dione
Also Known As: (E)-5-benzylidene-3-butylthiazolidine-2,4-dione, (5E)-3-BUTYL-5-(PHENYLMETHYLIDENE)-1,3-THIAZOLIDINE-2,4-DIONE, (5E)-5-benzylidene-3-butyl-1,3-thiazolidine-2,4-dione, F1075-0155, 3-butyl-5-(phenylmethylene)-1,3-thiazolidine-2,4-dione
| Molecular Formula | C14H15NO2S |
|---|---|
| Molecular Weight | 261.08 g/mol |
| LogP | 3.523 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.08234 |
| Heavy Atoms | 18 |
| Complexity | 481.82718 |
Chemical Identifiers
| CAS Number | 5835-44-9 |
|---|---|
| SMILES | CCCCN1C(=O)/C(=C\C2=CC=CC=C2)/SC1=O |
Product Overview
(E)-5-benzylidene-3-butylthiazolidine-2,4-dione (CAS 5835-44-9), with molecular formula C14H15NO2S and molecular weight 261.08 g/mol. IUPAC: (5E)-5-benzylidene-3-butyl-1,3-thiazolidine-2,4-dione.
Chemical Property Profile of (E)-5-benzylidene-3-butylthiazolidine-2,4-dione
Property Insights of (E)-5-benzylidene-3-butylthiazolidine-2,4-dione
The XLogP value of 3.523 indicates that (E)-5-benzylidene-3-butylthiazolidine-2,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.38 Ų, (E)-5-benzylidene-3-butylthiazolidine-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-5-benzylidene-3-butylthiazolidine-2,4-dione has 0 hydrogen bond donor(s) and 3 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)-5-benzylidene-3-butylthiazolidine-2,4-dione?
The CAS number of (E)-5-benzylidene-3-butylthiazolidine-2,4-dione is 5835-44-9.
What is the molecular formula of (E)-5-benzylidene-3-butylthiazolidine-2,4-dione?
The molecular formula of (E)-5-benzylidene-3-butylthiazolidine-2,4-dione is C14H15NO2S.
What is the molecular weight of (E)-5-benzylidene-3-butylthiazolidine-2,4-dione?
The molecular weight of (E)-5-benzylidene-3-butylthiazolidine-2,4-dione is 261.08 g/mol.
Where can I buy (E)-5-benzylidene-3-butylthiazolidine-2,4-dione?
You can request a quote for (E)-5-benzylidene-3-butylthiazolidine-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)-5-benzylidene-3-butylthiazolidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-benzylidene-3-butylthiazolidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.