AF-399/41945632
TL;DR: AF-399/41945632 (CAS 609792-21-4) is a chemical compound with molecular formula C26H25N3O4 and molecular weight 443.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxopropyl]benzo[de]isoquinoline-1,3-dione
Also Known As: AF-399/41945632, 2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxopropyl]benzo[de]isoquinoline-1,3-dione, 2-{3-[4-(2-methoxyphenyl)-1-piperazinyl]-3-oxopropyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione, 2-{3-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione
| Molecular Formula | C26H25N3O4 |
|---|---|
| Molecular Weight | 443.18 g/mol |
| LogP | 3.1833 |
| Topological Polar Surface Area | 70.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 443.1845 |
| Heavy Atoms | 33 |
| Complexity | 1196.5205 |
Chemical Identifiers
| CAS Number | 609792-21-4 |
|---|---|
| SMILES | COC1=CC=CC=C1N2CCN(CC2)C(=O)CCN3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O |
Product Overview
AF-399/41945632 (CAS 609792-21-4), with molecular formula C26H25N3O4 and molecular weight 443.18 g/mol. IUPAC: 2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxopropyl]benzo[de]isoquinoline-1,3-dione.
Chemical Property Profile of AF-399/41945632
Property Insights of AF-399/41945632
The XLogP value of 3.1833 indicates that AF-399/41945632 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.16 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/41945632. Following Lipinski's Rule of Five, AF-399/41945632 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-399/41945632?
The CAS number of AF-399/41945632 is 609792-21-4.
What is the molecular formula of AF-399/41945632?
The molecular formula of AF-399/41945632 is C26H25N3O4.
What is the molecular weight of AF-399/41945632?
The molecular weight of AF-399/41945632 is 443.18 g/mol.
Where can I buy AF-399/41945632?
You can request a quote for AF-399/41945632 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41945632?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41945632 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.