1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)-
TL;DR: 1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)- (CAS 63031-38-9) is a chemical compound with molecular formula C18H17N3S and molecular weight 307.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-bis(4-methylphenyl)-3-methylsulfanyl-1,2,4-triazine
Also Known As: 5,6-Bis(p-tolyl)-3-(methylthio)-as-triazine, 5-26-03-00387 (Beilstein Handbook Reference), as-Triazine, 5,6-di-(p-tolyl)-3-(methylthio)-, 1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)-, 5,6-Di(p-tolyl)-3-methylthio-1,2,4-triazine
| Molecular Formula | C18H17N3S |
|---|---|
| Molecular Weight | 307.11 g/mol |
| LogP | 4.54434 |
| Topological Polar Surface Area | 38.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 307.11432 |
| Heavy Atoms | 22 |
| Complexity | 780.43256 |
Chemical Identifiers
| CAS Number | 63031-38-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=C(N=NC(=N2)SC)C3=CC=C(C=C3)C |
Product Overview
1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)- (CAS 63031-38-9), with molecular formula C18H17N3S and molecular weight 307.11 g/mol. IUPAC: 5,6-bis(4-methylphenyl)-3-methylsulfanyl-1,2,4-triazine.
Chemical Property Profile of 1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)-
Property Insights of 1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)-
The XLogP value of 4.54434 indicates that 1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.67 Ų, 1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)- 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 1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)-?
The CAS number of 1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)- is 63031-38-9.
What is the molecular formula of 1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)-?
The molecular formula of 1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)- is C18H17N3S.
What is the molecular weight of 1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)-?
The molecular weight of 1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)- is 307.11 g/mol.
Where can I buy 1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)-?
You can request a quote for 1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)-?
Yes, KEHONG BIO provides custom synthesis services for 1,2,4-Triazine, 5,6-bis(4-methylphenyl)-3-(methylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.