AF-399/37285006
TL;DR: AF-399/37285006 (CAS 342780-77-2) is a chemical compound with molecular formula C25H25N5O and molecular weight 411.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: AF-399/37285006, 1-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile, 1-[4-(4-methoxybenzyl)-1-piperazinyl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile, 1-(4-(4-Methoxybenzyl)piperazin-1-yl)-3-methylbenzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 1-[4-(4-methoxybenzyl)piperazin-1-yl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
| Molecular Formula | C25H25N5O |
|---|---|
| Molecular Weight | 411.21 g/mol |
| LogP | 3.9984 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 411.2059 |
| Heavy Atoms | 31 |
| Complexity | 1277.5007 |
Chemical Identifiers
| CAS Number | 342780-77-2 |
|---|---|
| SMILES | CC1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CCN(CC4)CC5=CC=C(C=C5)OC)C#N |
Product Overview
AF-399/37285006 (CAS 342780-77-2), with molecular formula C25H25N5O and molecular weight 411.21 g/mol. IUPAC: 1-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of AF-399/37285006
Property Insights of AF-399/37285006
The XLogP value of 3.9984 indicates that AF-399/37285006 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.8 Ų, AF-399/37285006 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AF-399/37285006 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 AF-399/37285006?
The CAS number of AF-399/37285006 is 342780-77-2.
What is the molecular formula of AF-399/37285006?
The molecular formula of AF-399/37285006 is C25H25N5O.
What is the molecular weight of AF-399/37285006?
The molecular weight of AF-399/37285006 is 411.21 g/mol.
Where can I buy AF-399/37285006?
You can request a quote for AF-399/37285006 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/37285006?
Yes, KEHONG BIO provides custom synthesis services for AF-399/37285006 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.