6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione
TL;DR: 6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione (CAS 290835-05-1) is a chemical compound with molecular formula C11H8BrN3O3S and molecular weight 340.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-2H-1,2,4-triazine-3,5-dione
Also Known As: AB00682024-01, 6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione, F3095-4582, 6-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-2H-1,2,4-triazine-3,5-dione, 1-(4-bromophenyl)-2-[(3,5-dihydroxy-1,2,4-triazin-6-yl)sulfanyl]ethanone
| Molecular Formula | C11H8BrN3O3S |
|---|---|
| Molecular Weight | 340.95 g/mol |
| LogP | 1.1957 |
| Topological Polar Surface Area | 95.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 340.94696 |
| Heavy Atoms | 19 |
| Complexity | 708.1156 |
Chemical Identifiers
| CAS Number | 290835-05-1 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)CSC2=NNC(=O)NC2=O)Br |
Product Overview
6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione (CAS 290835-05-1), with molecular formula C11H8BrN3O3S and molecular weight 340.95 g/mol. IUPAC: 6-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-2H-1,2,4-triazine-3,5-dione.
Chemical Property Profile of 6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione
Property Insights of 6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione
The XLogP value of 1.1957 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione. The TPSA of 95.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione. Following Lipinski's Rule of Five, 6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione has 2 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 6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione?
The CAS number of 6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione is 290835-05-1.
What is the molecular formula of 6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione?
The molecular formula of 6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione is C11H8BrN3O3S.
What is the molecular weight of 6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione?
The molecular weight of 6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione is 340.95 g/mol.
Where can I buy 6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione?
You can request a quote for 6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-((2-(4-bromophenyl)-2-oxoethyl)thio)-1,2,4-triazine-3,5(2H,4H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.