![1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one structure](/static/products/3314/331460-66-3.webp)
1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one
TL;DR: 1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one (CAS 331460-66-3) is a chemical compound with molecular formula C16H13ClO4S and molecular weight 336.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[3-(4-chlorophenyl)-3-oxoprop-1-enyl]phenyl] methanesulfonate
Also Known As: [4-[3-(4-chlorophenyl)-3-oxoprop-1-enyl]phenyl] methanesulfonate, 1-(4-chlorophenyl)-3-(4-methylsulfonyloxyphenyl)prop-2-en-1-one, 1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one, 4-[(E)-3-(4-chlorophenyl)-3-oxo-1-propenyl]phenyl methanesulfonate, 4-[3-(4-CHLOROPHENYL)-3-OXOPROP-1-EN-1-YL]PHENYL METHANESULFONATE
| Molecular Formula | C16H13ClO4S |
|---|---|
| Molecular Weight | 336.02 g/mol |
| LogP | 3.5745 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 336.0223 |
| Heavy Atoms | 22 |
| Complexity | 791.0444 |
Chemical Identifiers
| CAS Number | 331460-66-3 |
|---|---|
| SMILES | CS(=O)(=O)OC1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)Cl |
Product Overview
1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one (CAS 331460-66-3), with molecular formula C16H13ClO4S and molecular weight 336.02 g/mol. IUPAC: [4-[3-(4-chlorophenyl)-3-oxoprop-1-enyl]phenyl] methanesulfonate.
Chemical Property Profile of 1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one
Property Insights of 1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one
The XLogP value of 3.5745 indicates that 1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one 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 1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one 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 1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one?
The CAS number of 1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one is 331460-66-3.
What is the molecular formula of 1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one?
The molecular formula of 1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one is C16H13ClO4S.
What is the molecular weight of 1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one?
The molecular weight of 1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one is 336.02 g/mol.
Where can I buy 1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one?
You can request a quote for 1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorophenyl)-3-[4-[(methylsulfonyl)oxy]phenyl]-2-propen-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.