4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride
TL;DR: 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride (CAS 2798-18-7) is a chemical compound with molecular formula C18H38ClN3O2 and molecular weight 363.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 4-[2-[bis(2-methylpropyl)amino]ethyl]piperazine-1-carboxylate;hydrochloride
Also Known As: 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride, 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, propyl ester, hydrochloride, propyl 4-{2-[bis(2-methylpropyl)amino]ethyl}piperazine-1-carboxylate hydrochloride(1:1), propyl 4-[2-[bis(2-methylpropyl)amino]ethyl]piperazine-1-carboxylate hydrochloride, propyl 4-[2-[bis(2-methylpropyl)amino]ethyl]piperazine-1-carboxylate,hydrochloride
| Molecular Formula | C18H38ClN3O2 |
|---|---|
| Molecular Weight | 363.27 g/mol |
| LogP | 3.1864 |
| Topological Polar Surface Area | 36.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 363.26526 |
| Heavy Atoms | 24 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 2798-18-7 |
|---|---|
| SMILES | CCCOC(=O)N1CCN(CC1)CCN(CC(C)C)CC(C)C.Cl |
| InChIKey | JLXMYDQDLVRBIV-UHFFFAOYSA-N |
Product Overview
4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride (CAS 2798-18-7), with molecular formula C18H38ClN3O2 and molecular weight 363.27 g/mol. IUPAC: propyl 4-[2-[bis(2-methylpropyl)amino]ethyl]piperazine-1-carboxylate;hydrochloride.
Chemical Property Profile of 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride
Property Insights of 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride
The XLogP value of 3.1864 indicates that 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.0 Ų, 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride has 1 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 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride?
The CAS number of 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride is 2798-18-7.
What is the molecular formula of 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride?
The molecular formula of 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride is C18H38ClN3O2.
What is the molecular weight of 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride?
The molecular weight of 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride is 363.27 g/mol.
Where can I buy 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride?
You can request a quote for 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid propyl ester hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.