AE-848/41541443
TL;DR: AE-848/41541443 (CAS 500274-45-3) is a chemical compound with molecular formula C20H16N6O and molecular weight 356.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methoxyphenyl)-10-(4-methylphenyl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaene
Also Known As: AE-848/41541443, 2-(4-methoxyphenyl)-7-(4-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine, 2-(4-methoxyphenyl)-7-(p-tolyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine, methyl 4-[7-(4-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]phenyl ether
| Molecular Formula | C20H16N6O |
|---|---|
| Molecular Weight | 356.14 g/mol |
| LogP | 3.44722 |
| Topological Polar Surface Area | 70.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 356.13855 |
| Heavy Atoms | 27 |
| Complexity | 1251.8755 |
Chemical Identifiers
| CAS Number | 500274-45-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C3=C(C=N2)C4=NC(=NN4C=N3)C5=CC=C(C=C5)OC |
Product Overview
AE-848/41541443 (CAS 500274-45-3), with molecular formula C20H16N6O and molecular weight 356.14 g/mol. IUPAC: 4-(4-methoxyphenyl)-10-(4-methylphenyl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaene.
Chemical Property Profile of AE-848/41541443
Property Insights of AE-848/41541443
The XLogP value of 3.44722 indicates that AE-848/41541443 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.13 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/41541443. Following Lipinski's Rule of Five, AE-848/41541443 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 AE-848/41541443?
The CAS number of AE-848/41541443 is 500274-45-3.
What is the molecular formula of AE-848/41541443?
The molecular formula of AE-848/41541443 is C20H16N6O.
What is the molecular weight of AE-848/41541443?
The molecular weight of AE-848/41541443 is 356.14 g/mol.
Where can I buy AE-848/41541443?
You can request a quote for AE-848/41541443 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/41541443?
Yes, KEHONG BIO provides custom synthesis services for AE-848/41541443 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.