![Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate structure](/static/products/4780/478077-51-9.webp)
Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate
TL;DR: Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate (CAS 478077-51-9) is a chemical compound with molecular formula C16H22FN3O3 and molecular weight 323.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[4-(4-fluorophenyl)piperazin-1-yl]-2-methoxyiminopropanoate
Also Known As: ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate, ethyl 3-[4-(4-fluorophenyl)piperazin-1-yl]-2-methoxyiminopropanoate, Ethyl 3-[4-(4-fluorophenyl)piperazin-1-yl]-2-methoxyimino-propanoate
| Molecular Formula | C16H22FN3O3 |
|---|---|
| Molecular Weight | 323.16 g/mol |
| LogP | 1.5132 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 323.16452 |
| Heavy Atoms | 23 |
| Complexity | 540.00635 |
Chemical Identifiers
| CAS Number | 478077-51-9 |
|---|---|
| SMILES | CCOC(=O)C(=NOC)CN1CCN(CC1)C2=CC=C(C=C2)F |
Product Overview
Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate (CAS 478077-51-9), with molecular formula C16H22FN3O3 and molecular weight 323.16 g/mol. IUPAC: ethyl 3-[4-(4-fluorophenyl)piperazin-1-yl]-2-methoxyiminopropanoate.
Chemical Property Profile of Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate
Property Insights of Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate
The XLogP value of 1.5132 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate. With a topological polar surface area (TPSA) of 54.37 Ų, Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate has 0 hydrogen bond donor(s) and 6 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 Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate?
The CAS number of Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate is 478077-51-9.
What is the molecular formula of Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate?
The molecular formula of Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate is C16H22FN3O3.
What is the molecular weight of Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate?
The molecular weight of Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate is 323.16 g/mol.
Where can I buy Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate?
You can request a quote for Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-[4-(4-fluorophenyl)piperazino]-2-(methoxyimino)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.