4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate
TL;DR: 4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate (CAS 869341-55-9) is a chemical compound with molecular formula C22H15FO5S and molecular weight 410.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methyl-2-oxo-3-phenylchromen-6-yl) 4-fluorobenzenesulfonate
Also Known As: 4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate, AB01327985-02, 4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzene-1-sulfonate, (4-methyl-2-oxo-3-phenylchromen-6-yl) 4-fluorobenzenesulfonate, F1865-0104
| Molecular Formula | C22H15FO5S |
|---|---|
| Molecular Weight | 410.06 g/mol |
| LogP | 4.67522 |
| Topological Polar Surface Area | 73.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 410.0624 |
| Heavy Atoms | 29 |
| Complexity | 1358.4946 |
Chemical Identifiers
| CAS Number | 869341-55-9 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4 |
Product Overview
4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate (CAS 869341-55-9), with molecular formula C22H15FO5S and molecular weight 410.06 g/mol. IUPAC: (4-methyl-2-oxo-3-phenylchromen-6-yl) 4-fluorobenzenesulfonate.
Chemical Property Profile of 4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate
Property Insights of 4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate
The XLogP value of 4.67522 indicates that 4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate. Following Lipinski's Rule of Five, 4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate has 0 hydrogen bond donor(s) and 5 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 4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate?
The CAS number of 4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate is 869341-55-9.
What is the molecular formula of 4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate?
The molecular formula of 4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate is C22H15FO5S.
What is the molecular weight of 4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate?
The molecular weight of 4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate is 410.06 g/mol.
Where can I buy 4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate?
You can request a quote for 4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-2-oxo-3-phenyl-2H-chromen-6-yl 4-fluorobenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.