4-(2-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl ester hydrochloride
TL;DR: 4-(2-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl ester hydrochloride (CAS 280571-86-0) 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.
ethyl 4-[1-(dibutylamino)propan-2-yl]piperazine-1-carboxylate;hydrochloride
Also Known As: 4-(2-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl ester hydrochloride, 1-Piperazinecarboxylic acid, 4-(2-(dibutylamino)-1-methylethyl)-, ethyl ester, hydrochloride, ethyl 4-[1-(dibutylamino)propan-2-yl]piperazine-1-carboxylate hydrochloride(1:1), 1-Piperazinecarboxylicacid, 4-[2-(dibutylamino)-1-methylethyl]-, ethyl ester, hydrochloride (1:1), ethyl 4-[1-(dibutylamino)propan-2-yl]piperazine-1-carboxylate hydrochloride
| Molecular Formula | C18H38ClN3O2 |
|---|---|
| Molecular Weight | 363.27 g/mol |
| LogP | 3.473 |
| Topological Polar Surface Area | 36.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 363.26526 |
| Heavy Atoms | 24 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 280571-86-0 |
|---|---|
| SMILES | CCCCN(CCCC)CC(C)N1CCN(CC1)C(=O)OCC.Cl |
| InChIKey | BVVJGYXJPAIQTK-UHFFFAOYSA-N |
Product Overview
4-(2-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl ester hydrochloride (CAS 280571-86-0), with molecular formula C18H38ClN3O2 and molecular weight 363.27 g/mol. IUPAC: ethyl 4-[1-(dibutylamino)propan-2-yl]piperazine-1-carboxylate;hydrochloride.
Chemical Property Profile of 4-(2-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl ester hydrochloride
Property Insights of 4-(2-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl ester hydrochloride
The XLogP value of 3.473 indicates that 4-(2-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl 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-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl ester hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl 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-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl ester hydrochloride?
The CAS number of 4-(2-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl ester hydrochloride is 280571-86-0.
What is the molecular formula of 4-(2-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl ester hydrochloride?
The molecular formula of 4-(2-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl ester hydrochloride is C18H38ClN3O2.
What is the molecular weight of 4-(2-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl ester hydrochloride?
The molecular weight of 4-(2-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl ester hydrochloride is 363.27 g/mol.
Where can I buy 4-(2-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl ester hydrochloride?
You can request a quote for 4-(2-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl 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-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl ester hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-(Dibutylamino)-1-methylethyl)-1-piperazinecarboxylic acid ethyl ester hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.