as-Triazine, 5-(9-anthracenyl)-3-(methylthio)-
TL;DR: as-Triazine, 5-(9-anthracenyl)-3-(methylthio)- (CAS 69467-14-7) is a chemical compound with molecular formula C18H13N3S and molecular weight 303.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-anthracen-9-yl-3-methylsulfanyl-1,2,4-triazine
Also Known As: as-Triazine, 5-(9-anthracenyl)-3-(methylthio)-, 5-(9-Anthracenyl)-3-(methylthio)-as-triazine, 1,2,4-Triazine, 5-(9-anthracenyl)-3-(methylthio)-, 5-26-03-00404 (Beilstein Handbook Reference), 5-(9-Anthracenyl)-3-methylthio-1,2,4-triazine
| Molecular Formula | C18H13N3S |
|---|---|
| Molecular Weight | 303.08 g/mol |
| LogP | 4.5669 |
| Topological Polar Surface Area | 38.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 303.083 |
| Heavy Atoms | 22 |
| Complexity | 927.94617 |
Chemical Identifiers
| CAS Number | 69467-14-7 |
|---|---|
| SMILES | CSC1=NC(=CN=N1)C2=C3C=CC=CC3=CC4=CC=CC=C42 |
Product Overview
as-Triazine, 5-(9-anthracenyl)-3-(methylthio)- (CAS 69467-14-7), with molecular formula C18H13N3S and molecular weight 303.08 g/mol. IUPAC: 5-anthracen-9-yl-3-methylsulfanyl-1,2,4-triazine.
Chemical Property Profile of as-Triazine, 5-(9-anthracenyl)-3-(methylthio)-
Property Insights of as-Triazine, 5-(9-anthracenyl)-3-(methylthio)-
The XLogP value of 4.5669 indicates that as-Triazine, 5-(9-anthracenyl)-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, as-Triazine, 5-(9-anthracenyl)-3-(methylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, as-Triazine, 5-(9-anthracenyl)-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 as-Triazine, 5-(9-anthracenyl)-3-(methylthio)-?
The CAS number of as-Triazine, 5-(9-anthracenyl)-3-(methylthio)- is 69467-14-7.
What is the molecular formula of as-Triazine, 5-(9-anthracenyl)-3-(methylthio)-?
The molecular formula of as-Triazine, 5-(9-anthracenyl)-3-(methylthio)- is C18H13N3S.
What is the molecular weight of as-Triazine, 5-(9-anthracenyl)-3-(methylthio)-?
The molecular weight of as-Triazine, 5-(9-anthracenyl)-3-(methylthio)- is 303.08 g/mol.
Where can I buy as-Triazine, 5-(9-anthracenyl)-3-(methylthio)-?
You can request a quote for as-Triazine, 5-(9-anthracenyl)-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-(9-anthracenyl)-3-(methylthio)-?
Yes, KEHONG BIO provides custom synthesis services for as-Triazine, 5-(9-anthracenyl)-3-(methylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.