AE-848/32950023
TL;DR: AE-848/32950023 (CAS 319491-34-4) is a chemical compound with molecular formula C22H12N4O4S and molecular weight 428.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(furan-2-yl)-6-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanylpyridine-3,5-dicarbonitrile
Also Known As: AE-848/32950023, 2-amino-4-(furan-2-yl)-6-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanylpyridine-3,5-dicarbonitrile, AH-034/11963420, 2-amino-4-(2-furyl)-6-{[2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl]sulfanyl}-3,5-pyridinedicarbonitrile, 2-amino-4-(furan-2-yl)-6-((2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl)thio)pyridine-3,5-dicarbonitrile
| Molecular Formula | C22H12N4O4S |
|---|---|
| Molecular Weight | 428.06 g/mol |
| LogP | 3.74856 |
| Topological Polar Surface Area | 146.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 428.05792 |
| Heavy Atoms | 31 |
| Complexity | 1460.1256 |
Chemical Identifiers
| CAS Number | 319491-34-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)CSC3=C(C(=C(C(=N3)N)C#N)C4=CC=CO4)C#N |
Product Overview
AE-848/32950023 (CAS 319491-34-4), with molecular formula C22H12N4O4S and molecular weight 428.06 g/mol. IUPAC: 2-amino-4-(furan-2-yl)-6-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanylpyridine-3,5-dicarbonitrile.
Chemical Property Profile of AE-848/32950023
Property Insights of AE-848/32950023
The XLogP value of 3.74856 indicates that AE-848/32950023 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 146.91 Ų indicates high polarity, suggesting AE-848/32950023 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AE-848/32950023 has 1 hydrogen bond donor(s) and 9 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-848/32950023?
The CAS number of AE-848/32950023 is 319491-34-4.
What is the molecular formula of AE-848/32950023?
The molecular formula of AE-848/32950023 is C22H12N4O4S.
What is the molecular weight of AE-848/32950023?
The molecular weight of AE-848/32950023 is 428.06 g/mol.
Where can I buy AE-848/32950023?
You can request a quote for AE-848/32950023 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/32950023?
Yes, KEHONG BIO provides custom synthesis services for AE-848/32950023 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.