AE-848/34089001
TL;DR: AE-848/34089001 (CAS 201274-16-0) is a chemical compound with molecular formula C25H28N4OS and molecular weight 432.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-cyano-6-hexylsulfanyl-2-methyl-N-phenyl-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxamide
Also Known As: AE-848/34089001, 5-cyano-6-(hexylsulfanyl)-2-methyl-N-phenyl-1,4-dihydro-4,4'-bipyridine-3-carboxamide, 5-cyano-6-(hexylthio)-2-methyl-N-phenyl-1,4-dihydro-[4,4'-bipyridine]-3-carboxamide, 5-cyano-6-hexylsulfanyl-2-methyl-N-phenyl-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxamide
| Molecular Formula | C25H28N4OS |
|---|---|
| Molecular Weight | 432.20 g/mol |
| LogP | 5.72978 |
| Topological Polar Surface Area | 77.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 432.1984 |
| Heavy Atoms | 31 |
| Complexity | 993.187 |
Chemical Identifiers
| CAS Number | 201274-16-0 |
|---|---|
| SMILES | CCCCCCSC1=C(C(C(=C(N1)C)C(=O)NC2=CC=CC=C2)C3=CC=NC=C3)C#N |
Product Overview
AE-848/34089001 (CAS 201274-16-0), with molecular formula C25H28N4OS and molecular weight 432.20 g/mol. IUPAC: 5-cyano-6-hexylsulfanyl-2-methyl-N-phenyl-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxamide.
Chemical Property Profile of AE-848/34089001
Property Insights of AE-848/34089001
The XLogP value of 5.72978 indicates that AE-848/34089001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.81 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/34089001. Following Lipinski's Rule of Five, AE-848/34089001 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AE-848/34089001?
The CAS number of AE-848/34089001 is 201274-16-0.
What is the molecular formula of AE-848/34089001?
The molecular formula of AE-848/34089001 is C25H28N4OS.
What is the molecular weight of AE-848/34089001?
The molecular weight of AE-848/34089001 is 432.20 g/mol.
Where can I buy AE-848/34089001?
You can request a quote for AE-848/34089001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/34089001?
Yes, KEHONG BIO provides custom synthesis services for AE-848/34089001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.