RefChem:233605
TL;DR: RefChem:233605 (CAS 27982-06-5) 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.
propan-2-yl 4-[2-[bis(2-methylpropyl)amino]ethyl]piperazine-1-carboxylate;hydrochloride
Also Known As: 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, isopropyl ester, hydrochloride, 4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid isopropyl ester hydrochloride, propan-2-yl 4-{2-[bis(2-methylpropyl)amino]ethyl}piperazine-1-carboxylate hydrochloride(1:1), propan-2-yl 4-[2-[bis(2-methylpropyl)amino]ethyl]piperazine-1-carboxylate hydrochloride, propan-2-yl 4-[2-[bis(2-methylpropyl)amino]ethyl]piperazine-1-carboxylate,hydrochloride
| Molecular Formula | C18H38ClN3O2 |
|---|---|
| Molecular Weight | 363.27 g/mol |
| LogP | 3.1848 |
| Topological Polar Surface Area | 36.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 363.26526 |
| Heavy Atoms | 24 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 27982-06-5 |
|---|---|
| SMILES | CC(C)CN(CCN1CCN(CC1)C(=O)OC(C)C)CC(C)C.Cl |
| InChIKey | CALGIJZSIFCUPJ-UHFFFAOYSA-N |
Product Overview
RefChem:233605 (CAS 27982-06-5), with molecular formula C18H38ClN3O2 and molecular weight 363.27 g/mol. IUPAC: propan-2-yl 4-[2-[bis(2-methylpropyl)amino]ethyl]piperazine-1-carboxylate;hydrochloride.
Chemical Property Profile of RefChem:233605
Property Insights of RefChem:233605
The XLogP value of 3.1848 indicates that RefChem:233605 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.0 Ų, RefChem:233605 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:233605 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 RefChem:233605?
The CAS number of RefChem:233605 is 27982-06-5.
What is the molecular formula of RefChem:233605?
The molecular formula of RefChem:233605 is C18H38ClN3O2.
What is the molecular weight of RefChem:233605?
The molecular weight of RefChem:233605 is 363.27 g/mol.
Where can I buy RefChem:233605?
You can request a quote for RefChem:233605 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:233605?
Yes, KEHONG BIO provides custom synthesis services for RefChem:233605 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.