2,4-Diethyl-6-(methylsulfanyl)-1,3,5-triazine
TL;DR: 2,4-Diethyl-6-(methylsulfanyl)-1,3,5-triazine (CAS 3846-74-0) is a chemical compound with molecular formula C8H13N3S and molecular weight 183.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-diethyl-6-methylsulfanyl-1,3,5-triazine
Also Known As: 2,4-diethyl-6-(methylsulfanyl)-1,3,5-triazine, 2,4-Diethyl-6-methylthio-1,3,5-triazine, 2,4-DIETHYL-6-METHYLTHIO-S-TRIAZINE, J1.553.690J, 2,4-diethyl-6-methylsulfanyl-1,3,5-triazine
| Molecular Formula | C8H13N3S |
|---|---|
| Molecular Weight | 183.08 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 64.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 183.08302 |
| Heavy Atoms | 12 |
| Complexity | 119.0 |
Chemical Identifiers
| CAS Number | 3846-74-0 |
|---|---|
| SMILES | CCC1=NC(=NC(=N1)SC)CC |
| InChIKey | YQIJFDPXOCAWIT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-Diethyl-6-(methylsulfanyl)-1,3,5-triazine (CAS 3846-74-0), with molecular formula C8H13N3S and molecular weight 183.08 g/mol. IUPAC: 2,4-diethyl-6-methylsulfanyl-1,3,5-triazine.
Chemical Property Profile of 2,4-Diethyl-6-(methylsulfanyl)-1,3,5-triazine
Property Insights of 2,4-Diethyl-6-(methylsulfanyl)-1,3,5-triazine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Diethyl-6-(methylsulfanyl)-1,3,5-triazine. The TPSA of 64.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Diethyl-6-(methylsulfanyl)-1,3,5-triazine. Following Lipinski's Rule of Five, 2,4-Diethyl-6-(methylsulfanyl)-1,3,5-triazine 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 2,4-Diethyl-6-(methylsulfanyl)-1,3,5-triazine?
The CAS number of 2,4-Diethyl-6-(methylsulfanyl)-1,3,5-triazine is 3846-74-0.
What is the molecular formula of 2,4-Diethyl-6-(methylsulfanyl)-1,3,5-triazine?
The molecular formula of 2,4-Diethyl-6-(methylsulfanyl)-1,3,5-triazine is C8H13N3S.
What is the molecular weight of 2,4-Diethyl-6-(methylsulfanyl)-1,3,5-triazine?
The molecular weight of 2,4-Diethyl-6-(methylsulfanyl)-1,3,5-triazine is 183.08 g/mol.
Where can I buy 2,4-Diethyl-6-(methylsulfanyl)-1,3,5-triazine?
You can request a quote for 2,4-Diethyl-6-(methylsulfanyl)-1,3,5-triazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Diethyl-6-(methylsulfanyl)-1,3,5-triazine?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Diethyl-6-(methylsulfanyl)-1,3,5-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.