6-[(4-Chlorophenoxy)methyl]-3-cyclohexyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
TL;DR: 6-[(4-Chlorophenoxy)methyl]-3-cyclohexyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CAS 862210-72-8) is a chemical compound with molecular formula C16H17ClN4OS and molecular weight 348.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(4-chlorophenoxy)methyl]-3-cyclohexyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: 6-((4-chlorophenoxy)methyl)-3-cyclohexyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-[(4-chlorophenoxy)methyl]-3-cyclohexyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-[(4-chlorophenoxy)methyl]-3-cyclohexyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C16H17ClN4OS |
|---|---|
| Molecular Weight | 348.08 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 80.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.08115 |
| Heavy Atoms | 23 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 862210-72-8 |
|---|---|
| SMILES | C1CCC(CC1)C2=NN=C3N2N=C(S3)COC4=CC=C(C=C4)Cl |
| InChIKey | KEXCHHRAUMHICJ-UHFFFAOYSA-N |
Product Overview
6-[(4-Chlorophenoxy)methyl]-3-cyclohexyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CAS 862210-72-8), with molecular formula C16H17ClN4OS and molecular weight 348.08 g/mol. IUPAC: 6-[(4-chlorophenoxy)methyl]-3-cyclohexyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of 6-[(4-Chlorophenoxy)methyl]-3-cyclohexyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Property Insights of 6-[(4-Chlorophenoxy)methyl]-3-cyclohexyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
The XLogP value of 4.6 indicates that 6-[(4-Chlorophenoxy)methyl]-3-cyclohexyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[(4-Chlorophenoxy)methyl]-3-cyclohexyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole. Following Lipinski's Rule of Five, 6-[(4-Chlorophenoxy)methyl]-3-cyclohexyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole has 0 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-[(4-Chlorophenoxy)methyl]-3-cyclohexyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
The CAS number of 6-[(4-Chlorophenoxy)methyl]-3-cyclohexyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is 862210-72-8.
What is the molecular formula of 6-[(4-Chlorophenoxy)methyl]-3-cyclohexyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
The molecular formula of 6-[(4-Chlorophenoxy)methyl]-3-cyclohexyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is C16H17ClN4OS.
What is the molecular weight of 6-[(4-Chlorophenoxy)methyl]-3-cyclohexyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
The molecular weight of 6-[(4-Chlorophenoxy)methyl]-3-cyclohexyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is 348.08 g/mol.
Where can I buy 6-[(4-Chlorophenoxy)methyl]-3-cyclohexyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
You can request a quote for 6-[(4-Chlorophenoxy)methyl]-3-cyclohexyl[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-[(4-Chlorophenoxy)methyl]-3-cyclohexyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 6-[(4-Chlorophenoxy)methyl]-3-cyclohexyl[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.