S-Triazine, 2-(benzylthio)-4,6-bis(trichloromethyl)-
TL;DR: S-Triazine, 2-(benzylthio)-4,6-bis(trichloromethyl)- (CAS 5516-51-8) is a chemical compound with molecular formula C12H7Cl6N3S and molecular weight 434.84918 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-benzylsulfanyl-4,6-bis(trichloromethyl)-1,3,5-triazine
Also Known As: 2-Benzylthio-4,6-bis -1,3,5-triazine, S-Triazine, 2-(benzylthio)-4,6-bis(trichloromethyl)-, 6-benzylthio-2,4-bis(trichloromethyl)-sym-triazine, 2-Benzylthio-4,6-bis(trichloromethyl)-1,3,5-triazine, 2-BENZYLTHIO-4,6-BIS(TRICHLOROMETHYL)-S-TRIAZI*
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H7Cl6N3S |
| Molecular Weight | 434.84918 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 64.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 436.84622 Da |
| Heavy Atoms | 22 |
| Complexity | 334.0 |
| SMILES | C1=CC=C(C=C1)CSC2=NC(=NC(=N2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl |
| InChIKey | QEMUVGKPNFMGAZ-UHFFFAOYSA-N |
Chemical Property Profile of S-Triazine, 2-(benzylthio)-4,6-bis(trichloromethyl)-
Property Insights of S-Triazine, 2-(benzylthio)-4,6-bis(trichloromethyl)-
The XLogP value of 5.6 indicates that S-Triazine, 2-(benzylthio)-4,6-bis(trichloromethyl)- 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 S-Triazine, 2-(benzylthio)-4,6-bis(trichloromethyl)-. Following Lipinski's Rule of Five, S-Triazine, 2-(benzylthio)-4,6-bis(trichloromethyl)- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of S-Triazine, 2-(benzylthio)-4,6-bis(trichloromethyl)-?
The CAS number of S-Triazine, 2-(benzylthio)-4,6-bis(trichloromethyl)- is 5516-51-8.
What is the molecular formula of S-Triazine, 2-(benzylthio)-4,6-bis(trichloromethyl)-?
The molecular formula of S-Triazine, 2-(benzylthio)-4,6-bis(trichloromethyl)- is C12H7Cl6N3S.
What is the molecular weight of S-Triazine, 2-(benzylthio)-4,6-bis(trichloromethyl)-?
The molecular weight of S-Triazine, 2-(benzylthio)-4,6-bis(trichloromethyl)- is 434.84918 g/mol.
Where can I buy S-Triazine, 2-(benzylthio)-4,6-bis(trichloromethyl)-?
You can request a quote for S-Triazine, 2-(benzylthio)-4,6-bis(trichloromethyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for S-Triazine, 2-(benzylthio)-4,6-bis(trichloromethyl)-?
Yes, CoreyChem provides custom synthesis services for S-Triazine, 2-(benzylthio)-4,6-bis(trichloromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.