4-(4-Benzylpiperazin-1-yl)-7-chloroquinoline
TL;DR: 4-(4-Benzylpiperazin-1-yl)-7-chloroquinoline (CAS 104668-07-7) is a chemical compound with molecular formula C20H20ClN3 and molecular weight 337.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-benzylpiperazin-1-yl)-7-chloroquinoline
Also Known As: 3-bromo-3-sulfolene, 4-(4-benzylpiperazin-1-yl)-7-chloroquinoline, Quinoline, 7-chloro-4-[4-(phenylmethyl)-1-piperazinyl]-, 4-(4-benzylpiperazin-1-yl)-7-chloro-quinoline
| Molecular Formula | C20H20ClN3 |
|---|---|
| Molecular Weight | 337.13 g/mol |
| LogP | 4.2104 |
| Topological Polar Surface Area | 19.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 337.13458 |
| Heavy Atoms | 24 |
| Complexity | 826.6665 |
Chemical Identifiers
| CAS Number | 104668-07-7 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2)C3=C4C=CC(=CC4=NC=C3)Cl |
Product Overview
4-(4-Benzylpiperazin-1-yl)-7-chloroquinoline (CAS 104668-07-7), with molecular formula C20H20ClN3 and molecular weight 337.13 g/mol. IUPAC: 4-(4-benzylpiperazin-1-yl)-7-chloroquinoline.
Chemical Property Profile of 4-(4-Benzylpiperazin-1-yl)-7-chloroquinoline
Property Insights of 4-(4-Benzylpiperazin-1-yl)-7-chloroquinoline
The XLogP value of 4.2104 indicates that 4-(4-Benzylpiperazin-1-yl)-7-chloroquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 19.37 Ų, 4-(4-Benzylpiperazin-1-yl)-7-chloroquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Benzylpiperazin-1-yl)-7-chloroquinoline 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 4-(4-Benzylpiperazin-1-yl)-7-chloroquinoline?
The CAS number of 4-(4-Benzylpiperazin-1-yl)-7-chloroquinoline is 104668-07-7.
What is the molecular formula of 4-(4-Benzylpiperazin-1-yl)-7-chloroquinoline?
The molecular formula of 4-(4-Benzylpiperazin-1-yl)-7-chloroquinoline is C20H20ClN3.
What is the molecular weight of 4-(4-Benzylpiperazin-1-yl)-7-chloroquinoline?
The molecular weight of 4-(4-Benzylpiperazin-1-yl)-7-chloroquinoline is 337.13 g/mol.
Where can I buy 4-(4-Benzylpiperazin-1-yl)-7-chloroquinoline?
You can request a quote for 4-(4-Benzylpiperazin-1-yl)-7-chloroquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Benzylpiperazin-1-yl)-7-chloroquinoline?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Benzylpiperazin-1-yl)-7-chloroquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.