5,6-Bis(4-chlorophenyl)-3-(methylsulfanyl)-1,2,4-triazine
TL;DR: 5,6-Bis(4-chlorophenyl)-3-(methylsulfanyl)-1,2,4-triazine (CAS 69466-88-2) is a chemical compound with molecular formula C16H11Cl2N3S and molecular weight 347.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-bis(4-chlorophenyl)-3-methylsulfanyl-1,2,4-triazine
Also Known As: 5,6-Bis -3-methylthio-1,2,4-triazine, 5,6-Bis(p-chloropheny)-3-(methylthio)-as-triazine, 1,2,4-Triazine, 5,6-bis(4-chlorophenyl)-3-(methylthio)-, 5-26-03-00379 (Beilstein Handbook Reference), as-Triazine, 5,6-bis(p-chlorophenyl)-3-(methylthio)-
| Molecular Formula | C16H11Cl2N3S |
|---|---|
| Molecular Weight | 347.01 g/mol |
| LogP | 5.2343 |
| Topological Polar Surface Area | 38.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 347.00507 |
| Heavy Atoms | 22 |
| Complexity | 789.4912 |
Chemical Identifiers
| CAS Number | 69466-88-2 |
|---|---|
| SMILES | CSC1=NC(=C(N=N1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl |
Product Overview
5,6-Bis(4-chlorophenyl)-3-(methylsulfanyl)-1,2,4-triazine (CAS 69466-88-2), with molecular formula C16H11Cl2N3S and molecular weight 347.01 g/mol. IUPAC: 5,6-bis(4-chlorophenyl)-3-methylsulfanyl-1,2,4-triazine.
Chemical Property Profile of 5,6-Bis(4-chlorophenyl)-3-(methylsulfanyl)-1,2,4-triazine
Property Insights of 5,6-Bis(4-chlorophenyl)-3-(methylsulfanyl)-1,2,4-triazine
The XLogP value of 5.2343 indicates that 5,6-Bis(4-chlorophenyl)-3-(methylsulfanyl)-1,2,4-triazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.67 Ų, 5,6-Bis(4-chlorophenyl)-3-(methylsulfanyl)-1,2,4-triazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6-Bis(4-chlorophenyl)-3-(methylsulfanyl)-1,2,4-triazine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5,6-Bis(4-chlorophenyl)-3-(methylsulfanyl)-1,2,4-triazine?
The CAS number of 5,6-Bis(4-chlorophenyl)-3-(methylsulfanyl)-1,2,4-triazine is 69466-88-2.
What is the molecular formula of 5,6-Bis(4-chlorophenyl)-3-(methylsulfanyl)-1,2,4-triazine?
The molecular formula of 5,6-Bis(4-chlorophenyl)-3-(methylsulfanyl)-1,2,4-triazine is C16H11Cl2N3S.
What is the molecular weight of 5,6-Bis(4-chlorophenyl)-3-(methylsulfanyl)-1,2,4-triazine?
The molecular weight of 5,6-Bis(4-chlorophenyl)-3-(methylsulfanyl)-1,2,4-triazine is 347.01 g/mol.
Where can I buy 5,6-Bis(4-chlorophenyl)-3-(methylsulfanyl)-1,2,4-triazine?
You can request a quote for 5,6-Bis(4-chlorophenyl)-3-(methylsulfanyl)-1,2,4-triazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-Bis(4-chlorophenyl)-3-(methylsulfanyl)-1,2,4-triazine?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Bis(4-chlorophenyl)-3-(methylsulfanyl)-1,2,4-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.