![1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile structure](/static/products/848/848765-00-4.png)
1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile
TL;DR: 1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile (CAS 848765-00-4) is a chemical compound with molecular formula C28H31N5O and molecular weight 453.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: 1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile, 1-{4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl}-3-(propan-2-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile, 2-(methylethyl)-4-{4-[2-(4-methylphenoxy)ethyl]piperazinyl}-5-hydropyridino[1, 2-a]benzimidazolecarbonitrile, 3-isopropyl-1-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile
| Molecular Formula | C28H31N5O |
|---|---|
| Molecular Weight | 453.25 g/mol |
| LogP | 4.992 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 453.25287 |
| Heavy Atoms | 34 |
| Complexity | 1341.4875 |
Chemical Identifiers
| CAS Number | 848765-00-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCCN2CCN(CC2)C3=CC(=C(C4=NC5=CC=CC=C5N34)C#N)C(C)C |
Product Overview
1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile (CAS 848765-00-4), with molecular formula C28H31N5O and molecular weight 453.25 g/mol. IUPAC: 1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of 1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile
Property Insights of 1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile
The XLogP value of 4.992 indicates that 1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-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, 1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-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 1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile?
The CAS number of 1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile is 848765-00-4.
What is the molecular formula of 1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile?
The molecular formula of 1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile is C28H31N5O.
What is the molecular weight of 1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile?
The molecular weight of 1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile is 453.25 g/mol.
Where can I buy 1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile?
You can request a quote for 1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-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-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.