![1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate structure](/static/products/2588/25888-94-2.webp)
1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate
TL;DR: 1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate (CAS 25888-94-2) is a chemical compound with molecular formula C15H21O6PS and molecular weight 360.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylsulfanylphenyl)ethyl 3-dimethoxyphosphoryloxybut-2-enoate
Also Known As: 1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate, 2-Butenoic acid, 3-[(dimethoxyphosphinyl)oxy]-, 1-[4-(methylthio)phenyl]ethyl ester
| Molecular Formula | C15H21O6PS |
|---|---|
| Molecular Weight | 360.08 g/mol |
| LogP | 4.334 |
| Topological Polar Surface Area | 71.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 360.07965 |
| Heavy Atoms | 23 |
| Complexity | 590.4896 |
Chemical Identifiers
| CAS Number | 25888-94-2 |
|---|---|
| SMILES | CC(C1=CC=C(C=C1)SC)OC(=O)C=C(C)OP(=O)(OC)OC |
Product Overview
1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate (CAS 25888-94-2), with molecular formula C15H21O6PS and molecular weight 360.08 g/mol. IUPAC: 1-(4-methylsulfanylphenyl)ethyl 3-dimethoxyphosphoryloxybut-2-enoate.
Chemical Property Profile of 1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate
Property Insights of 1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate
The XLogP value of 4.334 indicates that 1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate. Following Lipinski's Rule of Five, 1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate has 0 hydrogen bond donor(s) and 7 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-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate?
The CAS number of 1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate is 25888-94-2.
What is the molecular formula of 1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate?
The molecular formula of 1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate is C15H21O6PS.
What is the molecular weight of 1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate?
The molecular weight of 1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate is 360.08 g/mol.
Where can I buy 1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate?
You can request a quote for 1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(Methylsulfanyl)phenyl]ethyl 3-[(dimethoxyphosphoryl)oxy]but-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.