F2543-0590
TL;DR: F2543-0590 (CAS 896333-96-3) is a chemical compound with molecular formula C16H12F3N3OS and molecular weight 351.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-methyl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]pyrido[1,2-a][1,3,5]triazin-4-one
Also Known As: F2543-0590, 8-methyl-2-((4-(trifluoromethyl)benzyl)thio)-4H-pyrido[1,2-a][1,3,5]triazin-4-one, 8-methyl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]pyrido[1,2-a][1,3,5]triazin-4-one
| Molecular Formula | C16H12F3N3OS |
|---|---|
| Molecular Weight | 351.07 g/mol |
| LogP | 3.70902 |
| Topological Polar Surface Area | 47.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 351.0653 |
| Heavy Atoms | 24 |
| Complexity | 935.93585 |
Chemical Identifiers
| CAS Number | 896333-96-3 |
|---|---|
| SMILES | CC1=CC2=NC(=NC(=O)N2C=C1)SCC3=CC=C(C=C3)C(F)(F)F |
Product Overview
F2543-0590 (CAS 896333-96-3), with molecular formula C16H12F3N3OS and molecular weight 351.07 g/mol. IUPAC: 8-methyl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]pyrido[1,2-a][1,3,5]triazin-4-one.
Chemical Property Profile of F2543-0590
Property Insights of F2543-0590
The XLogP value of 3.70902 indicates that F2543-0590 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.26 Ų, F2543-0590 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F2543-0590 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 F2543-0590?
The CAS number of F2543-0590 is 896333-96-3.
What is the molecular formula of F2543-0590?
The molecular formula of F2543-0590 is C16H12F3N3OS.
What is the molecular weight of F2543-0590?
The molecular weight of F2543-0590 is 351.07 g/mol.
Where can I buy F2543-0590?
You can request a quote for F2543-0590 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2543-0590?
Yes, KEHONG BIO provides custom synthesis services for F2543-0590 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.