1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride
TL;DR: 1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride (CAS 98795-91-6) is a chemical compound with molecular formula C21H27ClN2O4 and molecular weight 406.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,5-dimethoxy-4-phenylmethoxyphenyl)-(4-methylpiperazin-1-yl)methanone;hydrochloride
Also Known As: 1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride, Piperazine, 1-(3,5-dimethoxy-4-(phenylmethoxy)benzoyl)-4-methyl-, monohydrochloride, (3,5-dimethoxy-4-phenylmethoxyphenyl)-(4-methylpiperazin-1-yl)methanone hydrochloride, [4-(Benzyloxy)-3,5-dimethoxyphenyl](4-methylpiperazin-1-yl)methanone--hydrogen chloride (1/1), RefChem:372147
| Molecular Formula | C21H27ClN2O4 |
|---|---|
| Molecular Weight | 406.17 g/mol |
| LogP | 3.0922 |
| Topological Polar Surface Area | 51.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 406.16592 |
| Heavy Atoms | 28 |
| Complexity | 752.2251 |
Chemical Identifiers
| CAS Number | 98795-91-6 |
|---|---|
| SMILES | CN1CCN(CC1)C(=O)C2=CC(=C(C(=C2)OC)OCC3=CC=CC=C3)OC.Cl |
Product Overview
1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride (CAS 98795-91-6), with molecular formula C21H27ClN2O4 and molecular weight 406.17 g/mol. IUPAC: (3,5-dimethoxy-4-phenylmethoxyphenyl)-(4-methylpiperazin-1-yl)methanone;hydrochloride.
Chemical Property Profile of 1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride
Property Insights of 1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride
The XLogP value of 3.0922 indicates that 1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.24 Ų, 1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride has 0 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 1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride?
The CAS number of 1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride is 98795-91-6.
What is the molecular formula of 1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride?
The molecular formula of 1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride is C21H27ClN2O4.
What is the molecular weight of 1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride?
The molecular weight of 1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride is 406.17 g/mol.
Where can I buy 1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride?
You can request a quote for 1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Benzyloxy-3,5-dimethoxybenzoyl)-4-methylpiperazine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.