3-Mercapto-5,6-diphenyl-1,2,4-triazine
TL;DR: 3-Mercapto-5,6-diphenyl-1,2,4-triazine (CAS 773879-30-4) is a chemical compound with molecular formula C15H11N3S and molecular weight 265.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-diphenyl-2H-1,2,4-triazine-3-thione
Also Known As: 5,6-Diphenyl-1,2,4-triazine-3-thiol, Icaridin, 5,6-diphenyl-1,2,4-triazine-3(2H)-thione, DPTZT, diphenyl-1,2,4-triazine-3-thiol
| Molecular Formula | C15H11N3S |
|---|---|
| Molecular Weight | 265.07 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 68.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.06738 |
| Heavy Atoms | 19 |
| Complexity | 402.0 |
Chemical Identifiers
| CAS Number | 773879-30-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=S)NN=C2C3=CC=CC=C3 |
| InChIKey | PESHFZNRQCTMDJ-UHFFFAOYSA-N |
Product Overview
3-Mercapto-5,6-diphenyl-1,2,4-triazine (CAS 773879-30-4), with molecular formula C15H11N3S and molecular weight 265.07 g/mol. IUPAC: 5,6-diphenyl-2H-1,2,4-triazine-3-thione.
Chemical Property Profile of 3-Mercapto-5,6-diphenyl-1,2,4-triazine
Property Insights of 3-Mercapto-5,6-diphenyl-1,2,4-triazine
The XLogP value of 3.2 indicates that 3-Mercapto-5,6-diphenyl-1,2,4-triazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Mercapto-5,6-diphenyl-1,2,4-triazine. Following Lipinski's Rule of Five, 3-Mercapto-5,6-diphenyl-1,2,4-triazine has 1 hydrogen bond donor(s) and 2 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 3-Mercapto-5,6-diphenyl-1,2,4-triazine?
The CAS number of 3-Mercapto-5,6-diphenyl-1,2,4-triazine is 773879-30-4.
What is the molecular formula of 3-Mercapto-5,6-diphenyl-1,2,4-triazine?
The molecular formula of 3-Mercapto-5,6-diphenyl-1,2,4-triazine is C15H11N3S.
What is the molecular weight of 3-Mercapto-5,6-diphenyl-1,2,4-triazine?
The molecular weight of 3-Mercapto-5,6-diphenyl-1,2,4-triazine is 265.07 g/mol.
Where can I buy 3-Mercapto-5,6-diphenyl-1,2,4-triazine?
You can request a quote for 3-Mercapto-5,6-diphenyl-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 3-Mercapto-5,6-diphenyl-1,2,4-triazine?
Yes, KEHONG BIO provides custom synthesis services for 3-Mercapto-5,6-diphenyl-1,2,4-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.