2-(Allylthio)-4,6-dichloro-1,3,5-triazine
TL;DR: 2-(Allylthio)-4,6-dichloro-1,3,5-triazine (CAS 25713-56-8) is a chemical compound with molecular formula C6H5Cl2N3S and molecular weight 220.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dichloro-6-prop-2-enylsulfanyl-1,3,5-triazine
Also Known As: 2-(Allylthio)-4,6-dichloro-s-triazine, 2-(Allylthio)-4,6-dichloro-1,3,5-triazine, 2-ALLYLTHIO-4,6-DICHLORO-S-TRIAZINE, J1.611.896F, 1,3,5-Triazine, 2,4-dichloro-6-(2-propen-1-ylthio)-
| Molecular Formula | C6H5Cl2N3S |
|---|---|
| Molecular Weight | 220.96 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 64.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 220.95813 |
| Heavy Atoms | 12 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 25713-56-8 |
|---|---|
| SMILES | C=CCSC1=NC(=NC(=N1)Cl)Cl |
| InChIKey | CAPAPJNZARLSQM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Allylthio)-4,6-dichloro-1,3,5-triazine (CAS 25713-56-8), with molecular formula C6H5Cl2N3S and molecular weight 220.96 g/mol. IUPAC: 2,4-dichloro-6-prop-2-enylsulfanyl-1,3,5-triazine.
Chemical Property Profile of 2-(Allylthio)-4,6-dichloro-1,3,5-triazine
Property Insights of 2-(Allylthio)-4,6-dichloro-1,3,5-triazine
The XLogP value of 3.4 indicates that 2-(Allylthio)-4,6-dichloro-1,3,5-triazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Allylthio)-4,6-dichloro-1,3,5-triazine. Following Lipinski's Rule of Five, 2-(Allylthio)-4,6-dichloro-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-(Allylthio)-4,6-dichloro-1,3,5-triazine?
The CAS number of 2-(Allylthio)-4,6-dichloro-1,3,5-triazine is 25713-56-8.
What is the molecular formula of 2-(Allylthio)-4,6-dichloro-1,3,5-triazine?
The molecular formula of 2-(Allylthio)-4,6-dichloro-1,3,5-triazine is C6H5Cl2N3S.
What is the molecular weight of 2-(Allylthio)-4,6-dichloro-1,3,5-triazine?
The molecular weight of 2-(Allylthio)-4,6-dichloro-1,3,5-triazine is 220.96 g/mol.
Where can I buy 2-(Allylthio)-4,6-dichloro-1,3,5-triazine?
You can request a quote for 2-(Allylthio)-4,6-dichloro-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-(Allylthio)-4,6-dichloro-1,3,5-triazine?
Yes, KEHONG BIO provides custom synthesis services for 2-(Allylthio)-4,6-dichloro-1,3,5-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.