1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl ester, hydrochloride
TL;DR: 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl ester, hydrochloride (CAS 28028-19-5) is a chemical compound with molecular formula C19H40ClN3O2 and molecular weight 377.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 4-[2-[bis(2-methylpropyl)amino]ethyl]piperazine-1-carboxylate;hydrochloride
Also Known As: 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl ester, hydrochloride, 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid butyl ester hydrochloride, 1-Piperazinecarboxylic acid,4-(2-(diisobutylamino)ethyl)-,butyl ester,hydrochloride, butyl 4-[2-[bis(2-methylpropyl)amino]ethyl]piperazine-1-carboxylate hydrochloride, butyl 4-[2-[bis(2-methylpropyl)amino]ethyl]piperazine-1-carboxylate,hydrochloride
| Molecular Formula | C19H40ClN3O2 |
|---|---|
| Molecular Weight | 377.28 g/mol |
| LogP | 3.5765 |
| Topological Polar Surface Area | 36.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 377.2809 |
| Heavy Atoms | 25 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 28028-19-5 |
|---|---|
| SMILES | CCCCOC(=O)N1CCN(CC1)CCN(CC(C)C)CC(C)C.Cl |
| InChIKey | AJOWQKMPFUQZLX-UHFFFAOYSA-N |
Product Overview
1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl ester, hydrochloride (CAS 28028-19-5), with molecular formula C19H40ClN3O2 and molecular weight 377.28 g/mol. IUPAC: butyl 4-[2-[bis(2-methylpropyl)amino]ethyl]piperazine-1-carboxylate;hydrochloride.
Chemical Property Profile of 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl ester, hydrochloride
Property Insights of 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl ester, hydrochloride
The XLogP value of 3.5765 indicates that 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl 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, 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl 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 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl ester, hydrochloride?
The CAS number of 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl ester, hydrochloride is 28028-19-5.
What is the molecular formula of 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl ester, hydrochloride?
The molecular formula of 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl ester, hydrochloride is C19H40ClN3O2.
What is the molecular weight of 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl ester, hydrochloride?
The molecular weight of 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl ester, hydrochloride is 377.28 g/mol.
Where can I buy 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl ester, hydrochloride?
You can request a quote for 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl ester, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, butyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.