5-(3-Bromobenzylidene)-rhodanine
TL;DR: 5-(3-Bromobenzylidene)-rhodanine (CAS 34709-44-9) is a chemical compound with molecular formula C10H6BrNOS2 and molecular weight 298.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3-bromophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 5-(3-bromobenzylidene)-rhodanine, (5E)-5-(3-BROMOBENZYLIDENE)-2-MERCAPTO-1,3-THIAZOL-4(5H)-ONE, (5Z)-5-[(3-bromophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, 5-[(3-bromophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C10H6BrNOS2 |
|---|---|
| Molecular Weight | 298.91 g/mol |
| LogP | 2.9379 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 298.9074 |
| Heavy Atoms | 15 |
| Complexity | 470.24512 |
Chemical Identifiers
| CAS Number | 34709-44-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)C=C2C(=O)NC(=S)S2 |
Product Overview
5-(3-Bromobenzylidene)-rhodanine (CAS 34709-44-9), with molecular formula C10H6BrNOS2 and molecular weight 298.91 g/mol. IUPAC: 5-[(3-bromophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of 5-(3-Bromobenzylidene)-rhodanine
Property Insights of 5-(3-Bromobenzylidene)-rhodanine
The XLogP value of 2.9379 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(3-Bromobenzylidene)-rhodanine. With a topological polar surface area (TPSA) of 29.1 Ų, 5-(3-Bromobenzylidene)-rhodanine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(3-Bromobenzylidene)-rhodanine has 1 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 5-(3-Bromobenzylidene)-rhodanine?
The CAS number of 5-(3-Bromobenzylidene)-rhodanine is 34709-44-9.
What is the molecular formula of 5-(3-Bromobenzylidene)-rhodanine?
The molecular formula of 5-(3-Bromobenzylidene)-rhodanine is C10H6BrNOS2.
What is the molecular weight of 5-(3-Bromobenzylidene)-rhodanine?
The molecular weight of 5-(3-Bromobenzylidene)-rhodanine is 298.91 g/mol.
Where can I buy 5-(3-Bromobenzylidene)-rhodanine?
You can request a quote for 5-(3-Bromobenzylidene)-rhodanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(3-Bromobenzylidene)-rhodanine?
Yes, KEHONG BIO provides custom synthesis services for 5-(3-Bromobenzylidene)-rhodanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.