F1727-0031
TL;DR: F1727-0031 (CAS 861147-22-0) is a chemical compound with molecular formula C26H26ClN5O and molecular weight 459.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)methyl]-1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: F1727-0031, 12-[(4-chlorophenyl)methyl]-13-[4-(2-hydroxyethyl)piperazin-1-yl]-11-methyl-1,8-diazatricyclo[7.4.0.0^{2,7}]trideca-2(7),3,5,8,10,12-hexaene-10-carbonitrile, 2-(4-chlorobenzyl)-1-(4-(2-hydroxyethyl)piperazin-1-yl)-3-methylbenzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 2-(4-chlorobenzyl)-1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile, 2-[(4-chlorophenyl)methyl]-1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
| Molecular Formula | C26H26ClN5O |
|---|---|
| Molecular Weight | 459.18 g/mol |
| LogP | 4.0261 |
| Topological Polar Surface Area | 67.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 459.1826 |
| Heavy Atoms | 33 |
| Complexity | 1347.6184 |
Chemical Identifiers
| CAS Number | 861147-22-0 |
|---|---|
| SMILES | CC1=C(C2=NC3=CC=CC=C3N2C(=C1CC4=CC=C(C=C4)Cl)N5CCN(CC5)CCO)C#N |
Product Overview
F1727-0031 (CAS 861147-22-0), with molecular formula C26H26ClN5O and molecular weight 459.18 g/mol. IUPAC: 2-[(4-chlorophenyl)methyl]-1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of F1727-0031
Property Insights of F1727-0031
The XLogP value of 4.0261 indicates that F1727-0031 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for F1727-0031. Following Lipinski's Rule of Five, F1727-0031 has 1 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 F1727-0031?
The CAS number of F1727-0031 is 861147-22-0.
What is the molecular formula of F1727-0031?
The molecular formula of F1727-0031 is C26H26ClN5O.
What is the molecular weight of F1727-0031?
The molecular weight of F1727-0031 is 459.18 g/mol.
Where can I buy F1727-0031?
You can request a quote for F1727-0031 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1727-0031?
Yes, KEHONG BIO provides custom synthesis services for F1727-0031 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.