AE-848/13196128
TL;DR: AE-848/13196128 (CAS 304870-98-2) is a chemical compound with molecular formula C24H36N4O2 and molecular weight 412.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-8-(2-methylpropyl)-6-(4-pentanoylpiperazin-1-yl)-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile
Also Known As: AE-848/13196128, 3,3-dimethyl-8-(2-methylpropyl)-6-(4-pentanoylpiperazin-1-yl)-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile, 3,3-dimethyl-8-(2-methylpropyl)-6-(4-pentanoylpiperazin-1-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile, 8-isobutyl-3,3-dimethyl-6-(4-pentanoyl-1-piperazinyl)-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile, 8-isobutyl-3,3-dimethyl-6-(4-pentanoylpiperazin-1-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
| Molecular Formula | C24H36N4O2 |
|---|---|
| Molecular Weight | 412.28 g/mol |
| LogP | 3.84188 |
| Topological Polar Surface Area | 69.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 412.2838 |
| Heavy Atoms | 30 |
| Complexity | 817.47534 |
Chemical Identifiers
| CAS Number | 304870-98-2 |
|---|---|
| SMILES | CCCCC(=O)N1CCN(CC1)C2=C(C3=C(COC(C3)(C)C)C(=N2)CC(C)C)C#N |
Product Overview
AE-848/13196128 (CAS 304870-98-2), with molecular formula C24H36N4O2 and molecular weight 412.28 g/mol. IUPAC: 3,3-dimethyl-8-(2-methylpropyl)-6-(4-pentanoylpiperazin-1-yl)-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile.
Chemical Property Profile of AE-848/13196128
Property Insights of AE-848/13196128
The XLogP value of 3.84188 indicates that AE-848/13196128 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.46 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/13196128. Following Lipinski's Rule of Five, AE-848/13196128 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-848/13196128?
The CAS number of AE-848/13196128 is 304870-98-2.
What is the molecular formula of AE-848/13196128?
The molecular formula of AE-848/13196128 is C24H36N4O2.
What is the molecular weight of AE-848/13196128?
The molecular weight of AE-848/13196128 is 412.28 g/mol.
Where can I buy AE-848/13196128?
You can request a quote for AE-848/13196128 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/13196128?
Yes, KEHONG BIO provides custom synthesis services for AE-848/13196128 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.