Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate
TL;DR: Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate (CAS 344280-52-0) is a chemical compound with molecular formula C18H17FO4 and molecular weight 316.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate
Also Known As: methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate, methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxo-butanoate, methyl2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate, 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoic acid methyl ester, 2-(4-fluorophenyl)-4-keto-4-(3-methoxyphenyl)butyric acid methyl ester
| Molecular Formula | C18H17FO4 |
|---|---|
| Molecular Weight | 316.11 g/mol |
| LogP | 3.3639 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 316.11108 |
| Heavy Atoms | 23 |
| Complexity | 694.4227 |
Chemical Identifiers
| CAS Number | 344280-52-0 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C(=O)CC(C2=CC=C(C=C2)F)C(=O)OC |
Product Overview
Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate (CAS 344280-52-0), with molecular formula C18H17FO4 and molecular weight 316.11 g/mol. IUPAC: methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate.
Chemical Property Profile of Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate
Property Insights of Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate
The XLogP value of 3.3639 indicates that Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate 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 Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate?
The CAS number of Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate is 344280-52-0.
What is the molecular formula of Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate?
The molecular formula of Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate is C18H17FO4.
What is the molecular weight of Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate?
The molecular weight of Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate is 316.11 g/mol.
Where can I buy Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate?
You can request a quote for Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.