Toquipidine
TL;DR: Toquipidine (CAS 112890-84-3) is a chemical compound with molecular formula C23H28N2O and molecular weight 348.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-(4-methylphenyl)-1H-isoquinolin-2-yl]-1-piperidin-1-ylethanol
Also Known As: Toquipidine, Compound 70026, 1-[1-(4-methylphenyl)-1H-isoquinolin-2-yl]-1-piperidin-1-ylethanol, 1-(4-Methylphenyl)-2-(2-piperidinoacetyl)-1,2,3,4-tetrahydroisoquinoline hydrochloride, 1,2,3,4-Tetrahydro-1-(4-methylphenyl)-2-(1-piperidinylacetyl)isoquinoline
| Molecular Formula | C23H28N2O |
|---|---|
| Molecular Weight | 348.22 g/mol |
| LogP | 4.52262 |
| Topological Polar Surface Area | 26.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 348.22015 |
| Heavy Atoms | 26 |
| Complexity | 788.11005 |
Chemical Identifiers
| CAS Number | 112890-84-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2C3=CC=CC=C3C=CN2C(C)(N4CCCCC4)O |
Product Overview
Toquipidine (CAS 112890-84-3), with molecular formula C23H28N2O and molecular weight 348.22 g/mol. IUPAC: 1-[1-(4-methylphenyl)-1H-isoquinolin-2-yl]-1-piperidin-1-ylethanol.
Chemical Property Profile of Toquipidine
Property Insights of Toquipidine
The XLogP value of 4.52262 indicates that Toquipidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.71 Ų, Toquipidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Toquipidine has 1 hydrogen bond donor(s) and 3 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 Toquipidine?
The CAS number of Toquipidine is 112890-84-3.
What is the molecular formula of Toquipidine?
The molecular formula of Toquipidine is C23H28N2O.
What is the molecular weight of Toquipidine?
The molecular weight of Toquipidine is 348.22 g/mol.
Where can I buy Toquipidine?
You can request a quote for Toquipidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Toquipidine?
Yes, KEHONG BIO provides custom synthesis services for Toquipidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.