5,6-Bis-(4-methoxyphenyl)-1,2,4-triazin-3-thione
TL;DR: 5,6-Bis-(4-methoxyphenyl)-1,2,4-triazin-3-thione (CAS 54866-65-8) is a chemical compound with molecular formula C17H15N3O2S and molecular weight 325.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-bis(4-methoxyphenyl)-2H-1,2,4-triazine-3-thione
Also Known As: 5,6-bis(4-methoxyphenyl)-1,2,4-triazine-3-thiol, 5,6-bis(4-methoxyphenyl)-2H-1,2,4-triazine-3-thione, 5,6-bis-(4-methoxyphenyl)-1,2,4-triazin-3-thione, 5,6-Bis(4-methoxyphenyl)-1,2,4-triazine-3(2H)-thione, AM-760/15238001
| Molecular Formula | C17H15N3O2S |
|---|---|
| Molecular Weight | 325.09 g/mol |
| LogP | 3.88539 |
| Topological Polar Surface Area | 60.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 325.0885 |
| Heavy Atoms | 23 |
| Complexity | 858.257 |
Chemical Identifiers
| CAS Number | 54866-65-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NC(=S)NN=C2C3=CC=C(C=C3)OC |
Product Overview
5,6-Bis-(4-methoxyphenyl)-1,2,4-triazin-3-thione (CAS 54866-65-8), with molecular formula C17H15N3O2S and molecular weight 325.09 g/mol. IUPAC: 5,6-bis(4-methoxyphenyl)-2H-1,2,4-triazine-3-thione.
Chemical Property Profile of 5,6-Bis-(4-methoxyphenyl)-1,2,4-triazin-3-thione
Property Insights of 5,6-Bis-(4-methoxyphenyl)-1,2,4-triazin-3-thione
The XLogP value of 3.88539 indicates that 5,6-Bis-(4-methoxyphenyl)-1,2,4-triazin-3-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,6-Bis-(4-methoxyphenyl)-1,2,4-triazin-3-thione. Following Lipinski's Rule of Five, 5,6-Bis-(4-methoxyphenyl)-1,2,4-triazin-3-thione has 1 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 5,6-Bis-(4-methoxyphenyl)-1,2,4-triazin-3-thione?
The CAS number of 5,6-Bis-(4-methoxyphenyl)-1,2,4-triazin-3-thione is 54866-65-8.
What is the molecular formula of 5,6-Bis-(4-methoxyphenyl)-1,2,4-triazin-3-thione?
The molecular formula of 5,6-Bis-(4-methoxyphenyl)-1,2,4-triazin-3-thione is C17H15N3O2S.
What is the molecular weight of 5,6-Bis-(4-methoxyphenyl)-1,2,4-triazin-3-thione?
The molecular weight of 5,6-Bis-(4-methoxyphenyl)-1,2,4-triazin-3-thione is 325.09 g/mol.
Where can I buy 5,6-Bis-(4-methoxyphenyl)-1,2,4-triazin-3-thione?
You can request a quote for 5,6-Bis-(4-methoxyphenyl)-1,2,4-triazin-3-thione 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-methoxyphenyl)-1,2,4-triazin-3-thione?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Bis-(4-methoxyphenyl)-1,2,4-triazin-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.