![1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile structure](/static/products/861/861146-86-3.png)
1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile
TL;DR: 1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile (CAS 861146-86-3) is a chemical compound with molecular formula C27H26N6 and molecular weight 434.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-imidazol-1-ylpropylamino)-3-methyl-2-[(4-methylphenyl)methyl]pyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: 1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 1-(3-imidazol-1-ylpropylamino)-3-methyl-2-[(4-methylphenyl)methyl]pyrido[1,2-a]benzimidazole-4-carbonitrile, 1-{[3-(1H-IMIDAZOL-1-YL)PROPYL]AMINO}-3-METHYL-2-(4-METHYLBENZYL)PYRIDO[1,2-A][1,3]BENZIMIDAZOL-4-YL CYANIDE, 1-{[3-(1H-imidazol-1-yl)propyl]amino}-3-methyl-2-(4-methylbenzyl)pyrido[1,2-a]benzimidazole-4-carbonitrile, 4-[(3-imidazolylpropyl)amino]-2-methyl-3-[(4-methylphenyl)methyl]-5-hydropyrid ino[1,2-a]benzimidazolecarbonitrile
| Molecular Formula | C27H26N6 |
|---|---|
| Molecular Weight | 434.22 g/mol |
| LogP | 5.26552 |
| Topological Polar Surface Area | 70.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 434.2219 |
| Heavy Atoms | 33 |
| Complexity | 1453.3533 |
Chemical Identifiers
| CAS Number | 861146-86-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CC2=C(N3C4=CC=CC=C4N=C3C(=C2C)C#N)NCCCN5C=CN=C5 |
Product Overview
1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile (CAS 861146-86-3), with molecular formula C27H26N6 and molecular weight 434.22 g/mol. IUPAC: 1-(3-imidazol-1-ylpropylamino)-3-methyl-2-[(4-methylphenyl)methyl]pyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of 1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile
Property Insights of 1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile
The XLogP value of 5.26552 indicates that 1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile. Following Lipinski's Rule of Five, 1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile?
The CAS number of 1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile is 861146-86-3.
What is the molecular formula of 1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile?
The molecular formula of 1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile is C27H26N6.
What is the molecular weight of 1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile?
The molecular weight of 1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile is 434.22 g/mol.
Where can I buy 1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile?
You can request a quote for 1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1-((3-(1H-imidazol-1-yl)propyl)amino)-3-methyl-2-(4-methylbenzyl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.