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Phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone
TL;DR: Phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone (CAS 123947-23-9) is a chemical compound with molecular formula C21H26N2O4 and molecular weight 370.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]methanone
Also Known As: AB00098439-01, Phenyl-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]methanone, phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone, 1-BENZOYL-4-[(3,4,5-TRIMETHOXYPHENYL)METHYL]PIPERAZINE, 1-(phenylcarbonyl)-4-{[3,4,5-tris(methyloxy)phenyl]methyl}piperazine
| Molecular Formula | C21H26N2O4 |
|---|---|
| Molecular Weight | 370.19 g/mol |
| LogP | 2.6704 |
| Topological Polar Surface Area | 51.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 370.18927 |
| Heavy Atoms | 27 |
| Complexity | 746.0011 |
Chemical Identifiers
| CAS Number | 123947-23-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)CN2CCN(CC2)C(=O)C3=CC=CC=C3 |
Product Overview
Phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone (CAS 123947-23-9), with molecular formula C21H26N2O4 and molecular weight 370.19 g/mol. IUPAC: phenyl-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]methanone.
Chemical Property Profile of Phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone
Property Insights of Phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone
The XLogP value of 2.6704 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone. With a topological polar surface area (TPSA) of 51.24 Ų, Phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone 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 Phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone?
The CAS number of Phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone is 123947-23-9.
What is the molecular formula of Phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone?
The molecular formula of Phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone is C21H26N2O4.
What is the molecular weight of Phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone?
The molecular weight of Phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone is 370.19 g/mol.
Where can I buy Phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone?
You can request a quote for Phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone?
Yes, KEHONG BIO provides custom synthesis services for Phenyl[4-(3,4,5-trimethoxybenzyl)piperazin-1-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.