1-(4-Methylpiperazin-1-yl)isoquinoline
TL;DR: 1-(4-Methylpiperazin-1-yl)isoquinoline (CAS 760945-99-1) is a chemical compound with molecular formula C14H17N3 and molecular weight 227.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylpiperazin-1-yl)isoquinoline
Also Known As: 1-(4-methylpiperazin-1-yl)isoquinoline, 1-(4-Methylpiperazinyl)-isoquinoline
| Molecular Formula | C14H17N3 |
|---|---|
| Molecular Weight | 227.14 g/mol |
| LogP | 1.9866 |
| Topological Polar Surface Area | 19.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 227.14224 |
| Heavy Atoms | 17 |
| Complexity | 510.36118 |
Chemical Identifiers
| CAS Number | 760945-99-1 |
|---|---|
| SMILES | CN1CCN(CC1)C2=NC=CC3=CC=CC=C32 |
Product Overview
1-(4-Methylpiperazin-1-yl)isoquinoline (CAS 760945-99-1), with molecular formula C14H17N3 and molecular weight 227.14 g/mol. IUPAC: 1-(4-methylpiperazin-1-yl)isoquinoline.
Chemical Property Profile of 1-(4-Methylpiperazin-1-yl)isoquinoline
Property Insights of 1-(4-Methylpiperazin-1-yl)isoquinoline
The XLogP value of 1.9866 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methylpiperazin-1-yl)isoquinoline. With a topological polar surface area (TPSA) of 19.37 Ų, 1-(4-Methylpiperazin-1-yl)isoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Methylpiperazin-1-yl)isoquinoline 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
Frequently Asked Questions
What is the CAS number of 1-(4-Methylpiperazin-1-yl)isoquinoline?
The CAS number of 1-(4-Methylpiperazin-1-yl)isoquinoline is 760945-99-1.
What is the molecular formula of 1-(4-Methylpiperazin-1-yl)isoquinoline?
The molecular formula of 1-(4-Methylpiperazin-1-yl)isoquinoline is C14H17N3.
What is the molecular weight of 1-(4-Methylpiperazin-1-yl)isoquinoline?
The molecular weight of 1-(4-Methylpiperazin-1-yl)isoquinoline is 227.14 g/mol.
Where can I buy 1-(4-Methylpiperazin-1-yl)isoquinoline?
You can request a quote for 1-(4-Methylpiperazin-1-yl)isoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methylpiperazin-1-yl)isoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methylpiperazin-1-yl)isoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.