F2567-0078
TL;DR: F2567-0078 (CAS 896310-08-0) is a chemical compound with molecular formula C18H13F3N2O4S and molecular weight 410.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-[(1-methylimidazol-2-yl)sulfanylmethyl]-4-oxopyran-3-yl] 2-(trifluoromethyl)benzoate
Also Known As: F2567-0078, 6-{[(1-methyl-1H-imidazol-2-yl)sulfanyl]methyl}-4-oxo-4H-pyran-3-yl 2-(trifluoromethyl)benzoate, [6-[(1-methylimidazol-2-yl)sulfanylmethyl]-4-oxopyran-3-yl] 2-(trifluoromethyl)benzoate, 6-(((1-methyl-1H-imidazol-2-yl)thio)methyl)-4-oxo-4H-pyran-3-yl 2-(trifluoromethyl)benzoate
| Molecular Formula | C18H13F3N2O4S |
|---|---|
| Molecular Weight | 410.05 g/mol |
| LogP | 3.9036 |
| Topological Polar Surface Area | 74.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 410.0548 |
| Heavy Atoms | 28 |
| Complexity | 1059.2245 |
Chemical Identifiers
| CAS Number | 896310-08-0 |
|---|---|
| SMILES | CN1C=CN=C1SCC2=CC(=O)C(=CO2)OC(=O)C3=CC=CC=C3C(F)(F)F |
Product Overview
F2567-0078 (CAS 896310-08-0), with molecular formula C18H13F3N2O4S and molecular weight 410.05 g/mol. IUPAC: [6-[(1-methylimidazol-2-yl)sulfanylmethyl]-4-oxopyran-3-yl] 2-(trifluoromethyl)benzoate.
Chemical Property Profile of F2567-0078
Property Insights of F2567-0078
The XLogP value of 3.9036 indicates that F2567-0078 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.33 Ų falls within the moderate polarity range, balancing permeability and solubility for F2567-0078. Following Lipinski's Rule of Five, F2567-0078 has 0 hydrogen bond donor(s) and 6 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 F2567-0078?
The CAS number of F2567-0078 is 896310-08-0.
What is the molecular formula of F2567-0078?
The molecular formula of F2567-0078 is C18H13F3N2O4S.
What is the molecular weight of F2567-0078?
The molecular weight of F2567-0078 is 410.05 g/mol.
Where can I buy F2567-0078?
You can request a quote for F2567-0078 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2567-0078?
Yes, KEHONG BIO provides custom synthesis services for F2567-0078 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.