3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride
TL;DR: 3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride (CAS 2428-36-6) is a chemical compound with molecular formula C23H31Cl2FN2O2 and molecular weight 456.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(1-ethoxy-2-phenylethyl)piperazin-1-yl]-1-(4-fluorophenyl)propan-1-one;dihydrochloride
Also Known As: 3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride, 3-[4-(1-ethoxy-2-phenylethyl)piperazin-1-yl]-1-(4-fluorophenyl)propan-1-one dihydrochloride, Propiophenone, 3-(4-(beta-ethoxyphenethyl)-1-piperazinyl)-4'-fluoro-, dihydrochloride, 1-(4-fluorophenyl)-3-[4-(2-methoxy-2-phenylethyl)piperazin-1-yl]propan-1-one dihydrochloride, 3-[4-(1-ethoxy-2-phenylethyl)piperazin-1-yl]-1-(4-fluorophenyl)propan-1-one,dihydrochloride
| Molecular Formula | C23H31Cl2FN2O2 |
|---|---|
| Molecular Weight | 456.17 g/mol |
| LogP | 4.465 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 456.17465 |
| Heavy Atoms | 30 |
| Complexity | 454.0 |
Chemical Identifiers
| CAS Number | 2428-36-6 |
|---|---|
| SMILES | CCOC(CC1=CC=CC=C1)N2CCN(CC2)CCC(=O)C3=CC=C(C=C3)F.Cl.Cl |
| InChIKey | DFLNVROISPZINC-UHFFFAOYSA-N |
Product Overview
3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride (CAS 2428-36-6), with molecular formula C23H31Cl2FN2O2 and molecular weight 456.17 g/mol. IUPAC: 3-[4-(1-ethoxy-2-phenylethyl)piperazin-1-yl]-1-(4-fluorophenyl)propan-1-one;dihydrochloride.
Chemical Property Profile of 3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride
Property Insights of 3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride
The XLogP value of 4.465 indicates that 3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.8 Ų, 3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride has 2 hydrogen bond donor(s) and 5 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-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride?
The CAS number of 3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride is 2428-36-6.
What is the molecular formula of 3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride?
The molecular formula of 3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride is C23H31Cl2FN2O2.
What is the molecular weight of 3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride?
The molecular weight of 3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride is 456.17 g/mol.
Where can I buy 3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride?
You can request a quote for 3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-4'-fluoropropiophenone dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.