AE-848/11828079
TL;DR: AE-848/11828079 (CAS 5603-02-1) is a chemical compound with molecular formula C21H16N2O3 and molecular weight 344.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-5-oxo-4-(1-phenylethyl)-4H-pyrano[3,2-c]chromene-3-carbonitrile
Also Known As: TimTec1_005915, AE-848/11828079, BAS 00866052, 2-amino-5-oxo-4-(1-phenylethyl)-4H,5H-pyrano[3,2-c]chromene-3-carbonitrile, A2182/0091701
| Molecular Formula | C21H16N2O3 |
|---|---|
| Molecular Weight | 344.12 g/mol |
| LogP | 3.76658 |
| Topological Polar Surface Area | 89.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 344.1161 |
| Heavy Atoms | 26 |
| Complexity | 1123.4417 |
Chemical Identifiers
| CAS Number | 5603-02-1 |
|---|---|
| SMILES | CC(C1C(=C(OC2=C1C(=O)OC3=CC=CC=C32)N)C#N)C4=CC=CC=C4 |
Product Overview
AE-848/11828079 (CAS 5603-02-1), with molecular formula C21H16N2O3 and molecular weight 344.12 g/mol. IUPAC: 2-amino-5-oxo-4-(1-phenylethyl)-4H-pyrano[3,2-c]chromene-3-carbonitrile.
Chemical Property Profile of AE-848/11828079
Property Insights of AE-848/11828079
The XLogP value of 3.76658 indicates that AE-848/11828079 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.25 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/11828079. Following Lipinski's Rule of Five, AE-848/11828079 has 1 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-848/11828079?
The CAS number of AE-848/11828079 is 5603-02-1.
What is the molecular formula of AE-848/11828079?
The molecular formula of AE-848/11828079 is C21H16N2O3.
What is the molecular weight of AE-848/11828079?
The molecular weight of AE-848/11828079 is 344.12 g/mol.
Where can I buy AE-848/11828079?
You can request a quote for AE-848/11828079 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/11828079?
Yes, KEHONG BIO provides custom synthesis services for AE-848/11828079 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.