2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate
TL;DR: 2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate (CAS 3563-46-0) is a chemical compound with molecular formula C20H36N2O2 and molecular weight 336.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylpiperazin-1-yl)ethyl 1-cyclohexylcyclohexane-1-carboxylate
Also Known As: 2-(4-Methyl-1-piperazinyl)ethyl bicyclohexyl-1-carboxylate, 4-23-00-00092 (Beilstein Handbook Reference), 2-(4-Methyl-1-piperazinyl)ethyl (bicyclohexyl)-1-carboxylate, (Bicyclohexyl)-1-carboxylic acid, 2-(4-methyl-1-piperazinyl)ethyl ester, 2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate
| Molecular Formula | C20H36N2O2 |
|---|---|
| Molecular Weight | 336.28 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 336.27768 |
| Heavy Atoms | 24 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 3563-46-0 |
|---|---|
| SMILES | CN1CCN(CC1)CCOC(=O)C2(CCCCC2)C3CCCCC3 |
| InChIKey | GQXUKXKRYHPQDY-UHFFFAOYSA-N |
Product Overview
2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate (CAS 3563-46-0), with molecular formula C20H36N2O2 and molecular weight 336.28 g/mol. IUPAC: 2-(4-methylpiperazin-1-yl)ethyl 1-cyclohexylcyclohexane-1-carboxylate.
Chemical Property Profile of 2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate
Property Insights of 2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate
The XLogP value of 4.6 indicates that 2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.8 Ų, 2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate has 0 hydrogen bond donor(s) and 4 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 2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate?
The CAS number of 2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate is 3563-46-0.
What is the molecular formula of 2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate?
The molecular formula of 2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate is C20H36N2O2.
What is the molecular weight of 2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate?
The molecular weight of 2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate is 336.28 g/mol.
Where can I buy 2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate?
You can request a quote for 2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methyl-1-piperazinyl)ethyl (1,1'-bicyclohexyl)-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.