4-(3-Oxo-3-phenyl-1-propenyl)phenyl 4-fluorobenzenesulfonate
TL;DR: 4-(3-Oxo-3-phenyl-1-propenyl)phenyl 4-fluorobenzenesulfonate (CAS 1010118-48-5) is a chemical compound with molecular formula C21H15FO4S and molecular weight 382.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(3-oxo-3-phenylprop-1-enyl)phenyl] 4-fluorobenzenesulfonate
Also Known As: 4-(3-oxo-3-phenyl-1-propenyl)phenyl 4-fluorobenzenesulfonate, [4-(3-oxo-3-phenylprop-1-enyl)phenyl] 4-fluorobenzenesulfonate, 4-(3-oxo-3-phenylprop-1-enyl)phenyl 4-fluorobenzene-1-sulphonate
| Molecular Formula | C21H15FO4S |
|---|---|
| Molecular Weight | 382.07 g/mol |
| LogP | 4.4895 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.0675 |
| Heavy Atoms | 27 |
| Complexity | 1055.4292 |
Chemical Identifiers
| CAS Number | 1010118-48-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)F |
Product Overview
4-(3-Oxo-3-phenyl-1-propenyl)phenyl 4-fluorobenzenesulfonate (CAS 1010118-48-5), with molecular formula C21H15FO4S and molecular weight 382.07 g/mol. IUPAC: [4-(3-oxo-3-phenylprop-1-enyl)phenyl] 4-fluorobenzenesulfonate.
Chemical Property Profile of 4-(3-Oxo-3-phenyl-1-propenyl)phenyl 4-fluorobenzenesulfonate
Property Insights of 4-(3-Oxo-3-phenyl-1-propenyl)phenyl 4-fluorobenzenesulfonate
The XLogP value of 4.4895 indicates that 4-(3-Oxo-3-phenyl-1-propenyl)phenyl 4-fluorobenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3-Oxo-3-phenyl-1-propenyl)phenyl 4-fluorobenzenesulfonate. Following Lipinski's Rule of Five, 4-(3-Oxo-3-phenyl-1-propenyl)phenyl 4-fluorobenzenesulfonate 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 4-(3-Oxo-3-phenyl-1-propenyl)phenyl 4-fluorobenzenesulfonate?
The CAS number of 4-(3-Oxo-3-phenyl-1-propenyl)phenyl 4-fluorobenzenesulfonate is 1010118-48-5.
What is the molecular formula of 4-(3-Oxo-3-phenyl-1-propenyl)phenyl 4-fluorobenzenesulfonate?
The molecular formula of 4-(3-Oxo-3-phenyl-1-propenyl)phenyl 4-fluorobenzenesulfonate is C21H15FO4S.
What is the molecular weight of 4-(3-Oxo-3-phenyl-1-propenyl)phenyl 4-fluorobenzenesulfonate?
The molecular weight of 4-(3-Oxo-3-phenyl-1-propenyl)phenyl 4-fluorobenzenesulfonate is 382.07 g/mol.
Where can I buy 4-(3-Oxo-3-phenyl-1-propenyl)phenyl 4-fluorobenzenesulfonate?
You can request a quote for 4-(3-Oxo-3-phenyl-1-propenyl)phenyl 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-(3-Oxo-3-phenyl-1-propenyl)phenyl 4-fluorobenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-Oxo-3-phenyl-1-propenyl)phenyl 4-fluorobenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.