as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)-
TL;DR: as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)- (CAS 69466-74-6) is a chemical compound with molecular formula C12H9N3OS and molecular weight 243.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1-benzofuran-2-yl)-3-methylsulfanyl-1,2,4-triazine
Also Known As: as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)-, 5- -3-methylthio-1,2,4-triazine, 5-(2-Benzofuranyl)-3-(methylthio)-as-triazine, 1,2,4-Triazine, 5-(2-benzofuranyl)-3-(methylthio)-, 5-(1-benzofuran-2-yl)-3-methylsulfanyl-1,2,4-triazine
| Molecular Formula | C12H9N3OS |
|---|---|
| Molecular Weight | 243.05 g/mol |
| LogP | 3.0067 |
| Topological Polar Surface Area | 51.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.04663 |
| Heavy Atoms | 17 |
| Complexity | 632.4144 |
Chemical Identifiers
| CAS Number | 69466-74-6 |
|---|---|
| SMILES | CSC1=NC(=CN=N1)C2=CC3=CC=CC=C3O2 |
Product Overview
as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)- (CAS 69466-74-6), with molecular formula C12H9N3OS and molecular weight 243.05 g/mol. IUPAC: 5-(1-benzofuran-2-yl)-3-methylsulfanyl-1,2,4-triazine.
Chemical Property Profile of as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)-
Property Insights of as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)-
The XLogP value of 3.0067 indicates that as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.81 Ų, as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)- has 0 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 as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)-?
The CAS number of as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)- is 69466-74-6.
What is the molecular formula of as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)-?
The molecular formula of as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)- is C12H9N3OS.
What is the molecular weight of as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)-?
The molecular weight of as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)- is 243.05 g/mol.
Where can I buy as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)-?
You can request a quote for as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)-?
Yes, KEHONG BIO provides custom synthesis services for as-Triazine, 5-(benzofuran-2-yl)-3-(methylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.