Acetophenone, 1-(4-benzylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride
TL;DR: Acetophenone, 1-(4-benzylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride (CAS 17837-65-9) is a chemical compound with molecular formula C22H30Cl2N2O4 and molecular weight 456.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-benzylpiperazin-1-yl)-1-(3,4,5-trimethoxyphenyl)ethanone;dihydrochloride
Also Known As: 1-Benzyl-4-(3,4,5-trimethoxybenzoylmethyl)piperidine dihydrochloride, 1-(4-Benzylpiperazinyl)-3',4',5'-trimethoxyacetophenone dihydrochloride, ACETOPHENONE, 1-(4-BENZYLPIPERAZINYL)-3',4',5'-TRIMETHOXY-, DIHYDROCHLORIDE, Piperidine, 1-benzyl-4-(3,4,5-trimethoxybenzoylmethyl)-, dihydrochloride, 2-(4-Benzyl-1-piperazinyl)-1-(3,4,5-trimethoxyphenyl)ethanone dihydrochloride
| Molecular Formula | C22H30Cl2N2O4 |
|---|---|
| Molecular Weight | 456.16 g/mol |
| LogP | 3.56 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 456.15826 |
| Heavy Atoms | 30 |
| Complexity | 461.0 |
Chemical Identifiers
| CAS Number | 17837-65-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)CN2CCN(CC2)CC3=CC=CC=C3.Cl.Cl |
| InChIKey | YHOPYFDMPZUVCS-UHFFFAOYSA-N |
Product Overview
Acetophenone, 1-(4-benzylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride (CAS 17837-65-9), with molecular formula C22H30Cl2N2O4 and molecular weight 456.16 g/mol. IUPAC: 2-(4-benzylpiperazin-1-yl)-1-(3,4,5-trimethoxyphenyl)ethanone;dihydrochloride.
Chemical Property Profile of Acetophenone, 1-(4-benzylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride
Property Insights of Acetophenone, 1-(4-benzylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride
The XLogP value of 3.56 indicates that Acetophenone, 1-(4-benzylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, Acetophenone, 1-(4-benzylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetophenone, 1-(4-benzylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride has 2 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 Acetophenone, 1-(4-benzylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride?
The CAS number of Acetophenone, 1-(4-benzylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride is 17837-65-9.
What is the molecular formula of Acetophenone, 1-(4-benzylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride?
The molecular formula of Acetophenone, 1-(4-benzylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride is C22H30Cl2N2O4.
What is the molecular weight of Acetophenone, 1-(4-benzylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride?
The molecular weight of Acetophenone, 1-(4-benzylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride is 456.16 g/mol.
Where can I buy Acetophenone, 1-(4-benzylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride?
You can request a quote for Acetophenone, 1-(4-benzylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetophenone, 1-(4-benzylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Acetophenone, 1-(4-benzylpiperazinyl)-3',4',5'-trimethoxy-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.