Isoquinoline, 1-(2-(4-phenyl-1-piperazinyl)ethyl)-
TL;DR: Isoquinoline, 1-(2-(4-phenyl-1-piperazinyl)ethyl)- (CAS 126921-46-8) is a chemical compound with molecular formula C21H23N3 and molecular weight 317.1892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-(4-phenylpiperazin-1-yl)ethyl]isoquinoline
Also Known As: Isoquinoline, 1-(2-(4-phenyl-1-piperazinyl)ethyl)-, 1-(2-(4-Phenyl-1-piperazinyl)ethyl)isoquinoline, 1H-Indole-3-carbonylchloride,1-methyl, 1-[2-(4-phenylpiperazin-1-yl)ethyl]isoquinoline, 1-(2-(4-Phenylpiperazin-1-yl)ethyl)isoquinoline
Technical Specifications
| Molecular Formula | C21H23N3 |
| Molecular Weight | 317.1892 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 19.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 317.1892 Da |
| Heavy Atoms | 24 |
| Complexity | 371.0 |
| SMILES | C1CN(CCN1CCC2=NC=CC3=CC=CC=C32)C4=CC=CC=C4 |
| InChIKey | AJAAZIPDXVNTLB-UHFFFAOYSA-N |
Chemical Property Profile of Isoquinoline, 1-(2-(4-phenyl-1-piperazinyl)ethyl)-
Property Insights of Isoquinoline, 1-(2-(4-phenyl-1-piperazinyl)ethyl)-
The XLogP value of 4.0 indicates that Isoquinoline, 1-(2-(4-phenyl-1-piperazinyl)ethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 19.4 Ų, Isoquinoline, 1-(2-(4-phenyl-1-piperazinyl)ethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinoline, 1-(2-(4-phenyl-1-piperazinyl)ethyl)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Isoquinoline, 1-(2-(4-phenyl-1-piperazinyl)ethyl)-?
The CAS number of Isoquinoline, 1-(2-(4-phenyl-1-piperazinyl)ethyl)- is 126921-46-8.
What is the molecular formula of Isoquinoline, 1-(2-(4-phenyl-1-piperazinyl)ethyl)-?
The molecular formula of Isoquinoline, 1-(2-(4-phenyl-1-piperazinyl)ethyl)- is C21H23N3.
What is the molecular weight of Isoquinoline, 1-(2-(4-phenyl-1-piperazinyl)ethyl)-?
The molecular weight of Isoquinoline, 1-(2-(4-phenyl-1-piperazinyl)ethyl)- is 317.1892 g/mol.
Where can I buy Isoquinoline, 1-(2-(4-phenyl-1-piperazinyl)ethyl)-?
You can request a quote for Isoquinoline, 1-(2-(4-phenyl-1-piperazinyl)ethyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isoquinoline, 1-(2-(4-phenyl-1-piperazinyl)ethyl)-?
Yes, CoreyChem provides custom synthesis services for Isoquinoline, 1-(2-(4-phenyl-1-piperazinyl)ethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.