![5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione structure](/static/products/6765/676521-72-5.webp)
5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
TL;DR: 5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 676521-72-5) is a chemical compound with molecular formula C15H8BrFN2O2S2 and molecular weight 409.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: 5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione, 5-[(5-Bromo-2-thienyl)methylene]-1-(2-fluorophenyl)dihydro-2-thioxo-4,6(1H,5H)-pyrimidinedione
| Molecular Formula | C15H8BrFN2O2S2 |
|---|---|
| Molecular Weight | 409.92 g/mol |
| LogP | 3.481 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 409.91946 |
| Heavy Atoms | 23 |
| Complexity | 862.6667 |
Chemical Identifiers
| CAS Number | 676521-72-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)N2C(=O)C(=CC3=CC=C(S3)Br)C(=O)NC2=S)F |
Product Overview
5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 676521-72-5), with molecular formula C15H8BrFN2O2S2 and molecular weight 409.92 g/mol. IUPAC: 5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of 5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Property Insights of 5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
The XLogP value of 3.481 indicates that 5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, 5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione 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 5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione?
The CAS number of 5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione is 676521-72-5.
What is the molecular formula of 5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular formula of 5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione is C15H8BrFN2O2S2.
What is the molecular weight of 5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular weight of 5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione is 409.92 g/mol.
Where can I buy 5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione?
You can request a quote for 5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(5-bromothiophen-2-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.