![6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine structure](/static/products/6785/6785-13-3.webp)
6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
TL;DR: 6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine (CAS 6785-13-3) is a chemical compound with molecular formula C18H17BrN4S2 and molecular weight 432.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Also Known As: 6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
| Molecular Formula | C18H17BrN4S2 |
|---|---|
| Molecular Weight | 432.01 g/mol |
| LogP | 5.7144 |
| Topological Polar Surface Area | 42.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 432.0078 |
| Heavy Atoms | 25 |
| Complexity | 948.3641 |
Chemical Identifiers
| CAS Number | 6785-13-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C2=NN=C3N2NC(=CS3)C4=CC=C(S4)Br |
Product Overview
6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine (CAS 6785-13-3), with molecular formula C18H17BrN4S2 and molecular weight 432.01 g/mol. IUPAC: 6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine.
Chemical Property Profile of 6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Property Insights of 6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
The XLogP value of 5.7144 indicates that 6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.74 Ų, 6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?
The CAS number of 6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine is 6785-13-3.
What is the molecular formula of 6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?
The molecular formula of 6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine is C18H17BrN4S2.
What is the molecular weight of 6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?
The molecular weight of 6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine is 432.01 g/mol.
Where can I buy 6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?
You can request a quote for 6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?
Yes, KEHONG BIO provides custom synthesis services for 6-(5-bromothiophen-2-yl)-3-(4-tert-butylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.