![11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile structure](/static/products/6837/683796-02-3.webp)
11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile
TL;DR: 11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile (CAS 683796-02-3) is a chemical compound with molecular formula C29H31N5O and molecular weight 465.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile
Also Known As: 11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile, F1126-0285, 11-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile, 9-{4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl}-10,17-diazatetracyclo[8.7.0.0^{3,8}.0^{11,16}]heptadeca-1(17),2,8,11(16),12,14-hexaene-2-carbonitrile, 11-{4-[2-(4-METHYLPHENOXY)ETHYL]-1-PIPERAZINYL}-7,8,9,10-TETRAHYDROBENZIMIDAZO[1,2-B]ISOQUINOLINE-6-CARBONITRILE
| Molecular Formula | C29H31N5O |
|---|---|
| Molecular Weight | 465.25 g/mol |
| LogP | 4.7474 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 465.25287 |
| Heavy Atoms | 35 |
| Complexity | 1407.5481 |
Chemical Identifiers
| CAS Number | 683796-02-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCCN2CCN(CC2)C3=C4CCCCC4=C(C5=NC6=CC=CC=C6N35)C#N |
Product Overview
11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile (CAS 683796-02-3), with molecular formula C29H31N5O and molecular weight 465.25 g/mol. IUPAC: 11-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile.
Chemical Property Profile of 11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile
Property Insights of 11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile
The XLogP value of 4.7474 indicates that 11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.8 Ų, 11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile has 0 hydrogen bond donor(s) and 5 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 11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile?
The CAS number of 11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile is 683796-02-3.
What is the molecular formula of 11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile?
The molecular formula of 11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile is C29H31N5O.
What is the molecular weight of 11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile?
The molecular weight of 11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile is 465.25 g/mol.
Where can I buy 11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile?
You can request a quote for 11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 11-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.