2-(Benzylsulfanyl)-4,6-dichloro-1,3,5-triazine
TL;DR: 2-(Benzylsulfanyl)-4,6-dichloro-1,3,5-triazine (CAS 25713-57-9) is a chemical compound with molecular formula C10H7Cl2N3S and molecular weight 270.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-4,6-dichloro-1,3,5-triazine
Also Known As: 2-(benzylsulfanyl)-4,6-dichloro-1,3,5-triazine, 2-(Benzylthio)-4,6-dichloro-1,3,5-triazine, 2-(Benzylthio)-4,6-dichloro-s-triazine, 2-benzylsulfanyl-4,6-dichloro-1,3,5-triazine, 2-BENZYLTHIO-4,6-DICHLORO-S-TRIAZINE
| Molecular Formula | C10H7Cl2N3S |
|---|---|
| Molecular Weight | 270.97 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 64.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 270.9738 |
| Heavy Atoms | 16 |
| Complexity | 204.0 |
Chemical Identifiers
| CAS Number | 25713-57-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=NC(=NC(=N2)Cl)Cl |
| InChIKey | DMEZLIQUTNGCOB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Benzylsulfanyl)-4,6-dichloro-1,3,5-triazine (CAS 25713-57-9), with molecular formula C10H7Cl2N3S and molecular weight 270.97 g/mol. IUPAC: 2-benzylsulfanyl-4,6-dichloro-1,3,5-triazine.
Chemical Property Profile of 2-(Benzylsulfanyl)-4,6-dichloro-1,3,5-triazine
Property Insights of 2-(Benzylsulfanyl)-4,6-dichloro-1,3,5-triazine
The XLogP value of 4.2 indicates that 2-(Benzylsulfanyl)-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-(Benzylsulfanyl)-4,6-dichloro-1,3,5-triazine. Following Lipinski's Rule of Five, 2-(Benzylsulfanyl)-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-(Benzylsulfanyl)-4,6-dichloro-1,3,5-triazine?
The CAS number of 2-(Benzylsulfanyl)-4,6-dichloro-1,3,5-triazine is 25713-57-9.
What is the molecular formula of 2-(Benzylsulfanyl)-4,6-dichloro-1,3,5-triazine?
The molecular formula of 2-(Benzylsulfanyl)-4,6-dichloro-1,3,5-triazine is C10H7Cl2N3S.
What is the molecular weight of 2-(Benzylsulfanyl)-4,6-dichloro-1,3,5-triazine?
The molecular weight of 2-(Benzylsulfanyl)-4,6-dichloro-1,3,5-triazine is 270.97 g/mol.
Where can I buy 2-(Benzylsulfanyl)-4,6-dichloro-1,3,5-triazine?
You can request a quote for 2-(Benzylsulfanyl)-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-(Benzylsulfanyl)-4,6-dichloro-1,3,5-triazine?
Yes, KEHONG BIO provides custom synthesis services for 2-(Benzylsulfanyl)-4,6-dichloro-1,3,5-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.