![6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole structure](/static/products/878/878701-55-4.png)
6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
TL;DR: 6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CAS 878701-55-4) is a chemical compound with molecular formula C14H16N4S and molecular weight 272.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: ASN 11413115, 6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, AO-365/43263945, 6-benzyl-3-tert-butyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C14H16N4S |
|---|---|
| Molecular Weight | 272.11 g/mol |
| LogP | 3.0741 |
| Topological Polar Surface Area | 43.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.10956 |
| Heavy Atoms | 19 |
| Complexity | 691.1308 |
Chemical Identifiers
| CAS Number | 878701-55-4 |
|---|---|
| SMILES | CC(C)(C)C1=NN=C2N1N=C(S2)CC3=CC=CC=C3 |
Product Overview
6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CAS 878701-55-4), with molecular formula C14H16N4S and molecular weight 272.11 g/mol. IUPAC: 6-benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of 6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Property Insights of 6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
The XLogP value of 3.0741 indicates that 6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.08 Ų, 6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole has 0 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 6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
The CAS number of 6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is 878701-55-4.
What is the molecular formula of 6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
The molecular formula of 6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is C14H16N4S.
What is the molecular weight of 6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
The molecular weight of 6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is 272.11 g/mol.
Where can I buy 6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
You can request a quote for 6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 6-Benzyl-3-tert-butyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.