![11-((3-chloro-4-methylphenyl)amino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile structure](/static/products/459/459191-68-5.png)
11-((3-chloro-4-methylphenyl)amino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile
TL;DR: 11-((3-chloro-4-methylphenyl)amino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile (CAS 459191-68-5) is a chemical compound with molecular formula C23H19ClN4 and molecular weight 386.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-(3-chloro-4-methylanilino)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile
Also Known As: 11-((3-chloro-4-methylphenyl)amino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile, 11-[(3-chloro-4-methylphenyl)amino]-7,8,9,10-tetrahydrobenzimidazo[1,2-b]isoquinoline-6-carbonitrile, 11-(3-chloro-4-methylanilino)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile, 11-[(3-chloro-4-methylphenyl)amino]-7,8,9,10,12-pentahydrobenzimidazolo[1,2-b] isoquinoline-6-carbonitrile
| Molecular Formula | C23H19ClN4 |
|---|---|
| Molecular Weight | 386.13 g/mol |
| LogP | 5.9434 |
| Topological Polar Surface Area | 53.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 386.12982 |
| Heavy Atoms | 28 |
| Complexity | 1279.7256 |
Chemical Identifiers
| CAS Number | 459191-68-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC2=C3CCCCC3=C(C4=NC5=CC=CC=C5N24)C#N)Cl |
Product Overview
11-((3-chloro-4-methylphenyl)amino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile (CAS 459191-68-5), with molecular formula C23H19ClN4 and molecular weight 386.13 g/mol. IUPAC: 11-(3-chloro-4-methylanilino)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile.
Chemical Property Profile of 11-((3-chloro-4-methylphenyl)amino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile
Property Insights of 11-((3-chloro-4-methylphenyl)amino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile
The XLogP value of 5.9434 indicates that 11-((3-chloro-4-methylphenyl)amino)-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 53.12 Ų, 11-((3-chloro-4-methylphenyl)amino)-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-((3-chloro-4-methylphenyl)amino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 11-((3-chloro-4-methylphenyl)amino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile?
The CAS number of 11-((3-chloro-4-methylphenyl)amino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile is 459191-68-5.
What is the molecular formula of 11-((3-chloro-4-methylphenyl)amino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile?
The molecular formula of 11-((3-chloro-4-methylphenyl)amino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile is C23H19ClN4.
What is the molecular weight of 11-((3-chloro-4-methylphenyl)amino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile?
The molecular weight of 11-((3-chloro-4-methylphenyl)amino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile is 386.13 g/mol.
Where can I buy 11-((3-chloro-4-methylphenyl)amino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile?
You can request a quote for 11-((3-chloro-4-methylphenyl)amino)-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-((3-chloro-4-methylphenyl)amino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 11-((3-chloro-4-methylphenyl)amino)-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.