![3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid structure](/static/products/204/204589-82-2.png)
3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid
TL;DR: 3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid (CAS 204589-82-2) is a chemical compound with molecular formula C25H22FNO4 and molecular weight 419.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[1-(4-fluorophenyl)-2-oxo-4-(4-phenylmethoxyphenyl)azetidin-3-yl]propanoic acid
Also Known As: 3-((2S,3R)-2-(4-(Benzyloxy)phenyl)-1-(4-fluorophenyl)-4-oxoazetidin-3-yl)propanoic acid, 4CH-019049, 3-[(3R,4S)-1-(4-fluorophenyl)-2-oxo-4-(4-phenylmethoxyphenyl)azetidin-3-yl]propanoic acid, 3-[2-(4-benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid, (3R,4S)-1-(4-Fluorophenyl)-2-oxo-4-[4-(benzyloxy)phenyl]-3-azetidinepropanoic acid
| Molecular Formula | C25H22FNO4 |
|---|---|
| Molecular Weight | 419.15 g/mol |
| LogP | 4.9736 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 419.1533 |
| Heavy Atoms | 31 |
| Complexity | 1051.1448 |
Chemical Identifiers
| CAS Number | 204589-82-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)C3C(C(=O)N3C4=CC=C(C=C4)F)CCC(=O)O |
Product Overview
3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid (CAS 204589-82-2), with molecular formula C25H22FNO4 and molecular weight 419.15 g/mol. IUPAC: 3-[1-(4-fluorophenyl)-2-oxo-4-(4-phenylmethoxyphenyl)azetidin-3-yl]propanoic acid.
Chemical Property Profile of 3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid
Property Insights of 3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid
The XLogP value of 4.9736 indicates that 3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid. Following Lipinski's Rule of Five, 3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid has 1 hydrogen bond donor(s) and 3 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 3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid?
The CAS number of 3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid is 204589-82-2.
What is the molecular formula of 3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid?
The molecular formula of 3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid is C25H22FNO4.
What is the molecular weight of 3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid?
The molecular weight of 3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid is 419.15 g/mol.
Where can I buy 3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid?
You can request a quote for 3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(4-Benzyloxyphenyl)-1-(4-fluorophenyl)-4-oxo-azetidin-3-yl]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.