(E)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)thiazolidine-2,4-dione
TL;DR: (E)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)thiazolidine-2,4-dione (CAS 769087-73-2) is a chemical compound with molecular formula C11H6BrNO4S and molecular weight 326.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-1,3-thiazolidine-2,4-dione
Also Known As: BIM-0019661.P001, (E)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)thiazolidine-2,4-dione, (5E)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-1,3-thiazolidine-2,4-dione, 5-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-1,3-thiazolidine-2,4-dione
| Molecular Formula | C11H6BrNO4S |
|---|---|
| Molecular Weight | 326.92 g/mol |
| LogP | 2.5017 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 326.9201 |
| Heavy Atoms | 18 |
| Complexity | 598.9512 |
Chemical Identifiers
| CAS Number | 769087-73-2 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C(=C2)/C=C/3\C(=O)NC(=O)S3)Br |
Product Overview
(E)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)thiazolidine-2,4-dione (CAS 769087-73-2), with molecular formula C11H6BrNO4S and molecular weight 326.92 g/mol. IUPAC: (5E)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-1,3-thiazolidine-2,4-dione.
Chemical Property Profile of (E)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)thiazolidine-2,4-dione
Property Insights of (E)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)thiazolidine-2,4-dione
The XLogP value of 2.5017 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)thiazolidine-2,4-dione. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)thiazolidine-2,4-dione. Following Lipinski's Rule of Five, (E)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)thiazolidine-2,4-dione has 1 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)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)thiazolidine-2,4-dione?
The CAS number of (E)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)thiazolidine-2,4-dione is 769087-73-2.
What is the molecular formula of (E)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)thiazolidine-2,4-dione?
The molecular formula of (E)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)thiazolidine-2,4-dione is C11H6BrNO4S.
What is the molecular weight of (E)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)thiazolidine-2,4-dione?
The molecular weight of (E)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)thiazolidine-2,4-dione is 326.92 g/mol.
Where can I buy (E)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)thiazolidine-2,4-dione?
You can request a quote for (E)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)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)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)thiazolidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)thiazolidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.