4-苯基哌嗪基3,4,5-三甲氧基苯基酮
TL;DR: 4-苯基哌嗪基3,4,5-三甲氧基苯基酮 (CAS 17766-63-1) is a chemical compound with molecular formula C20H24N2O4 and molecular weight 356.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-苯基哌嗪基3,4,5-三甲氧基苯基酮
(4-phenylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanone
Also Known As: 1-Phenyl-4-(3,4,5-trimethoxybenzoyl)piperazine, 4-Phenylpiperazinyl 3,4,5-trimethoxyphenyl ketone, (4-phenylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanone, Piperazine, 1-phenyl-4-(3,4,5-trimethoxybenzoyl)-, 5-23-01-00170 (Beilstein Handbook Reference)
| Molecular Formula | C20H24N2O4 |
|---|---|
| Molecular Weight | 356.17 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.1736 |
| Heavy Atoms | 26 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 17766-63-1 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C3=CC=CC=C3 |
| InChIKey | TYBAPDCCMCKUPD-UHFFFAOYSA-N |
Product Overview
4-苯基哌嗪基3,4,5-三甲氧基苯基酮 (CAS 17766-63-1), with molecular formula C20H24N2O4 and molecular weight 356.17 g/mol. IUPAC: (4-phenylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanone.
Chemical Property Profile of 4-苯基哌嗪基3,4,5-三甲氧基苯基酮
Property Insights of 4-苯基哌嗪基3,4,5-三甲氧基苯基酮
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-苯基哌嗪基3,4,5-三甲氧基苯基酮. With a topological polar surface area (TPSA) of 51.2 Ų, 4-苯基哌嗪基3,4,5-三甲氧基苯基酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-苯基哌嗪基3,4,5-三甲氧基苯基酮 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 4-苯基哌嗪基3,4,5-三甲氧基苯基酮?
The CAS number of 4-苯基哌嗪基3,4,5-三甲氧基苯基酮 is 17766-63-1.
What is the molecular formula of 4-苯基哌嗪基3,4,5-三甲氧基苯基酮?
The molecular formula of 4-苯基哌嗪基3,4,5-三甲氧基苯基酮 is C20H24N2O4.
What is the molecular weight of 4-苯基哌嗪基3,4,5-三甲氧基苯基酮?
The molecular weight of 4-苯基哌嗪基3,4,5-三甲氧基苯基酮 is 356.17 g/mol.
Where can I buy 4-苯基哌嗪基3,4,5-三甲氧基苯基酮?
You can request a quote for 4-苯基哌嗪基3,4,5-三甲氧基苯基酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-苯基哌嗪基3,4,5-三甲氧基苯基酮?
Yes, KEHONG BIO provides custom synthesis services for 4-苯基哌嗪基3,4,5-三甲氧基苯基酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.