![1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole structure](/static/products/307/307544-69-0.png)
1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole
TL;DR: 1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole (CAS 307544-69-0) is a chemical compound with molecular formula C16H13Cl2N3S and molecular weight 349.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-chlorophenyl)methyl]-5-[(4-chlorophenyl)methylsulfanyl]-1,2,4-triazole
Also Known As: 1-(4-chlorobenzyl)-5-((4-chlorobenzyl)thio)-1H-1,2,4-triazole, 1-(4-Chloro-benzyl)-5-(4-chloro-benzylsulfanyl)-1H-[1,2,4]triazole, 1-(4-chlorobenzyl)-5-[(4-chlorobenzyl)sulfanyl]-1H-1,2,4-triazole, 1-[(4-chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole, 1-[(4-chlorophenyl)methyl]-5-[(4-chlorophenyl)methylsulfanyl]-1,2,4-triazole
| Molecular Formula | C16H13Cl2N3S |
|---|---|
| Molecular Weight | 349.02 g/mol |
| LogP | 4.9255 |
| Topological Polar Surface Area | 30.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 349.02072 |
| Heavy Atoms | 22 |
| Complexity | 738.8423 |
Chemical Identifiers
| CAS Number | 307544-69-0 |
|---|---|
| SMILES | C1=CC(=CC=C1CN2C(=NC=N2)SCC3=CC=C(C=C3)Cl)Cl |
Product Overview
1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole (CAS 307544-69-0), with molecular formula C16H13Cl2N3S and molecular weight 349.02 g/mol. IUPAC: 1-[(4-chlorophenyl)methyl]-5-[(4-chlorophenyl)methylsulfanyl]-1,2,4-triazole.
Chemical Property Profile of 1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole
Property Insights of 1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole
The XLogP value of 4.9255 indicates that 1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.71 Ų, 1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole has 0 hydrogen bond donor(s) and 3 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 1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole?
The CAS number of 1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole is 307544-69-0.
What is the molecular formula of 1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole?
The molecular formula of 1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole is C16H13Cl2N3S.
What is the molecular weight of 1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole?
The molecular weight of 1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole is 349.02 g/mol.
Where can I buy 1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole?
You can request a quote for 1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-Chlorophenyl)methyl]-5-[(4-chlorophenyl)methylthio]-1,2,4-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.