2-(4-(Benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate
TL;DR: 2-(4-(Benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate (CAS 418783-23-0) is a chemical compound with molecular formula C24H19N3O2S and molecular weight 413.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-benzylsulfanyl-6-phenyl-1,3,5-triazin-2-yl)phenyl] acetate
Also Known As: 2-(4-(benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate, 2-[4-(benzylsulfanyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl acetate, [2-(4-benzylsulfanyl-6-phenyl-1,3,5-triazin-2-yl)phenyl] acetate
| Molecular Formula | C24H19N3O2S |
|---|---|
| Molecular Weight | 413.12 g/mol |
| LogP | 5.4232 |
| Topological Polar Surface Area | 64.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.1198 |
| Heavy Atoms | 30 |
| Complexity | 1151.4714 |
Chemical Identifiers
| CAS Number | 418783-23-0 |
|---|---|
| SMILES | CC(=O)OC1=CC=CC=C1C2=NC(=NC(=N2)C3=CC=CC=C3)SCC4=CC=CC=C4 |
Product Overview
2-(4-(Benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate (CAS 418783-23-0), with molecular formula C24H19N3O2S and molecular weight 413.12 g/mol. IUPAC: [2-(4-benzylsulfanyl-6-phenyl-1,3,5-triazin-2-yl)phenyl] acetate.
Chemical Property Profile of 2-(4-(Benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate
Property Insights of 2-(4-(Benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate
The XLogP value of 5.4232 indicates that 2-(4-(Benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-(Benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate. Following Lipinski's Rule of Five, 2-(4-(Benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(4-(Benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate?
The CAS number of 2-(4-(Benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate is 418783-23-0.
What is the molecular formula of 2-(4-(Benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate?
The molecular formula of 2-(4-(Benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate is C24H19N3O2S.
What is the molecular weight of 2-(4-(Benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate?
The molecular weight of 2-(4-(Benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate is 413.12 g/mol.
Where can I buy 2-(4-(Benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate?
You can request a quote for 2-(4-(Benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-(Benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-(Benzylthio)-6-phenyl-1,3,5-triazin-2-yl)phenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.