as-Triazine, 5-(3,4-dimethoxyphenyl)-3-(methylthio)-
TL;DR: as-Triazine, 5-(3,4-dimethoxyphenyl)-3-(methylthio)- (CAS 69466-72-4) is a chemical compound with molecular formula C12H13N3O2S and molecular weight 263.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,4-dimethoxyphenyl)-3-methylsulfanyl-1,2,4-triazine
Also Known As: as-Triazine, 5-(3,4-dimethoxyphenyl)-3-(methylthio)-, 5-(3,4-Dimethoxyphenyl)-3-(methylthio)-as-triazine, 5-26-03-00556 (Beilstein Handbook Reference), 1,2,4-Triazine, 5-(3,4-dimethoxyphenyl)-3-(methylthio)-, 5-(3,4-dimethoxyphenyl)-3-methylsulfanyl-1,2,4-triazine
| Molecular Formula | C12H13N3O2S |
|---|---|
| Molecular Weight | 263.07 g/mol |
| LogP | 2.2777 |
| Topological Polar Surface Area | 57.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 263.07285 |
| Heavy Atoms | 18 |
| Complexity | 548.59576 |
Chemical Identifiers
| CAS Number | 69466-72-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=CN=NC(=N2)SC)OC |
Product Overview
as-Triazine, 5-(3,4-dimethoxyphenyl)-3-(methylthio)- (CAS 69466-72-4), with molecular formula C12H13N3O2S and molecular weight 263.07 g/mol. IUPAC: 5-(3,4-dimethoxyphenyl)-3-methylsulfanyl-1,2,4-triazine.
Chemical Property Profile of as-Triazine, 5-(3,4-dimethoxyphenyl)-3-(methylthio)-
Property Insights of as-Triazine, 5-(3,4-dimethoxyphenyl)-3-(methylthio)-
The XLogP value of 2.2777 suggests moderate lipophilicity, balancing water solubility and membrane permeability for as-Triazine, 5-(3,4-dimethoxyphenyl)-3-(methylthio)-. With a topological polar surface area (TPSA) of 57.13 Ų, as-Triazine, 5-(3,4-dimethoxyphenyl)-3-(methylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, as-Triazine, 5-(3,4-dimethoxyphenyl)-3-(methylthio)- has 0 hydrogen bond donor(s) and 6 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-(3,4-dimethoxyphenyl)-3-(methylthio)-?
The CAS number of as-Triazine, 5-(3,4-dimethoxyphenyl)-3-(methylthio)- is 69466-72-4.
What is the molecular formula of as-Triazine, 5-(3,4-dimethoxyphenyl)-3-(methylthio)-?
The molecular formula of as-Triazine, 5-(3,4-dimethoxyphenyl)-3-(methylthio)- is C12H13N3O2S.
What is the molecular weight of as-Triazine, 5-(3,4-dimethoxyphenyl)-3-(methylthio)-?
The molecular weight of as-Triazine, 5-(3,4-dimethoxyphenyl)-3-(methylthio)- is 263.07 g/mol.
Where can I buy as-Triazine, 5-(3,4-dimethoxyphenyl)-3-(methylthio)-?
You can request a quote for as-Triazine, 5-(3,4-dimethoxyphenyl)-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-(3,4-dimethoxyphenyl)-3-(methylthio)-?
Yes, KEHONG BIO provides custom synthesis services for as-Triazine, 5-(3,4-dimethoxyphenyl)-3-(methylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.