AF-399/40712808
TL;DR: AF-399/40712808 (CAS 379236-24-5) is a chemical compound with molecular formula C22H24N4O2S and molecular weight 408.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]-2-[(5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethanone
Also Known As: AF-399/40712808, F1441-0108, 1-(1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl)-2-((5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)thio)ethanone, 1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-({5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)ethan-1-one, 1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]-2-[(5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethanone
| Molecular Formula | C22H24N4O2S |
|---|---|
| Molecular Weight | 408.16 g/mol |
| LogP | 4.23066 |
| Topological Polar Surface Area | 61.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 408.162 |
| Heavy Atoms | 29 |
| Complexity | 1208.6893 |
Chemical Identifiers
| CAS Number | 379236-24-5 |
|---|---|
| SMILES | CC1=CC2=NN=C(N2C3=CC=CC=C13)SCC(=O)C4=C(N(C(=C4)C)CCOC)C |
Product Overview
AF-399/40712808 (CAS 379236-24-5), with molecular formula C22H24N4O2S and molecular weight 408.16 g/mol. IUPAC: 1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]-2-[(5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethanone.
Chemical Property Profile of AF-399/40712808
Property Insights of AF-399/40712808
The XLogP value of 4.23066 indicates that AF-399/40712808 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.42 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/40712808. Following Lipinski's Rule of Five, AF-399/40712808 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-399/40712808?
The CAS number of AF-399/40712808 is 379236-24-5.
What is the molecular formula of AF-399/40712808?
The molecular formula of AF-399/40712808 is C22H24N4O2S.
What is the molecular weight of AF-399/40712808?
The molecular weight of AF-399/40712808 is 408.16 g/mol.
Where can I buy AF-399/40712808?
You can request a quote for AF-399/40712808 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/40712808?
Yes, KEHONG BIO provides custom synthesis services for AF-399/40712808 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.