1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride
TL;DR: 1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride (CAS 78033-79-1) is a chemical compound with molecular formula C22H32ClNO3 and molecular weight 393.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(4-butoxybut-2-ynyl)-4-phenylpiperidin-4-yl] propanoate;hydrochloride
Also Known As: 1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride, 1-(4'-n-Butoxybutyn-2'-yl)-4-phenyl-propionyloxypiperidine hydrochloride, 1-(4'-n-Butoxybutyn-2'yl)-4-phenyl-4-propionyloxypiperidine hydrochloride, 4-Piperidinol, 1-(4-butoxy-2-butynyl)-4-phenyl-, propionate (ester), hydrochloride, 1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate (ester) hydrochloride
| Molecular Formula | C22H32ClNO3 |
|---|---|
| Molecular Weight | 393.21 g/mol |
| LogP | 4.1728 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 393.20706 |
| Heavy Atoms | 27 |
| Complexity | 600.97906 |
Chemical Identifiers
| CAS Number | 78033-79-1 |
|---|---|
| SMILES | CCCCOCC#CCN1CCC(CC1)(C2=CC=CC=C2)OC(=O)CC.Cl |
Product Overview
1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride (CAS 78033-79-1), with molecular formula C22H32ClNO3 and molecular weight 393.21 g/mol. IUPAC: [1-(4-butoxybut-2-ynyl)-4-phenylpiperidin-4-yl] propanoate;hydrochloride.
Chemical Property Profile of 1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride
Property Insights of 1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride
The XLogP value of 4.1728 indicates that 1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.77 Ų, 1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride 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 1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride?
The CAS number of 1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride is 78033-79-1.
What is the molecular formula of 1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride?
The molecular formula of 1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride is C22H32ClNO3.
What is the molecular weight of 1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride?
The molecular weight of 1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride is 393.21 g/mol.
Where can I buy 1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride?
You can request a quote for 1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Butoxy-2-butynyl)-4-phenyl-4-piperidinol propionate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.