AE-848/32950032
TL;DR: AE-848/32950032 (CAS 327168-33-2) is a chemical compound with molecular formula C28H20N4O2S and molecular weight 476.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(4-methoxyphenyl)-6-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanylpyridine-3,5-dicarbonitrile
Also Known As: AE-848/32950032, 2-amino-4-(4-methoxyphenyl)-6-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanylpyridine-3,5-dicarbonitrile, 2-amino-6-{[2-(biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4-(4-methoxyphenyl)pyridine-3,5-dicarbonitrile, 2-amino-6-[(2-[1,1'-biphenyl]-4-yl-2-oxoethyl)sulfanyl]-4-(4-methoxyphenyl)-3,5-pyridinedicarbonitrile, 2-((2-([1,1'-biphenyl]-4-yl)-2-oxoethyl)thio)-6-amino-4-(4-methoxyphenyl)pyridine-3,5-dicarbonitrile
| Molecular Formula | C28H20N4O2S |
|---|---|
| Molecular Weight | 476.13 g/mol |
| LogP | 5.72476 |
| Topological Polar Surface Area | 112.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 476.1307 |
| Heavy Atoms | 35 |
| Complexity | 1453.0588 |
Chemical Identifiers
| CAS Number | 327168-33-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=C(C(=NC(=C2C#N)SCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)N)C#N |
Product Overview
AE-848/32950032 (CAS 327168-33-2), with molecular formula C28H20N4O2S and molecular weight 476.13 g/mol. IUPAC: 2-amino-4-(4-methoxyphenyl)-6-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanylpyridine-3,5-dicarbonitrile.
Chemical Property Profile of AE-848/32950032
Property Insights of AE-848/32950032
The XLogP value of 5.72476 indicates that AE-848/32950032 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.79 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/32950032. Following Lipinski's Rule of Five, AE-848/32950032 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AE-848/32950032?
The CAS number of AE-848/32950032 is 327168-33-2.
What is the molecular formula of AE-848/32950032?
The molecular formula of AE-848/32950032 is C28H20N4O2S.
What is the molecular weight of AE-848/32950032?
The molecular weight of AE-848/32950032 is 476.13 g/mol.
Where can I buy AE-848/32950032?
You can request a quote for AE-848/32950032 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/32950032?
Yes, KEHONG BIO provides custom synthesis services for AE-848/32950032 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.