AE-848/15116642
TL;DR: AE-848/15116642 (CAS 370844-83-0) is a chemical compound with molecular formula C26H21N3O2S and molecular weight 439.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2-[[3-cyano-4-(furan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]sulfanyl]acetamide
Also Known As: AE-848/15116642, N-benzyl-2-[3-cyano-4-(furan-2-yl)-6-(4-methylphenyl)pyridin-2-yl]sulfanylacetamide, N-benzyl-2-{[3-cyano-4-(furan-2-yl)-6-(4-methylphenyl)pyridin-2-yl]sulfanyl}acetamide, N-benzyl-2-((3-cyano-4-(furan-2-yl)-6-(p-tolyl)pyridin-2-yl)thio)acetamide, N-benzyl-2-{[3-cyano-4-(2-furyl)-6-(4-methylphenyl)pyridin-2-yl]sulfanyl}acetamide
| Molecular Formula | C26H21N3O2S |
|---|---|
| Molecular Weight | 439.14 g/mol |
| LogP | 5.5972 |
| Topological Polar Surface Area | 78.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 439.13544 |
| Heavy Atoms | 32 |
| Complexity | 1244.984 |
Chemical Identifiers
| CAS Number | 370844-83-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CO3)C#N)SCC(=O)NCC4=CC=CC=C4 |
Product Overview
AE-848/15116642 (CAS 370844-83-0), with molecular formula C26H21N3O2S and molecular weight 439.14 g/mol. IUPAC: N-benzyl-2-[[3-cyano-4-(furan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]sulfanyl]acetamide.
Chemical Property Profile of AE-848/15116642
Property Insights of AE-848/15116642
The XLogP value of 5.5972 indicates that AE-848/15116642 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.92 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/15116642. Following Lipinski's Rule of Five, AE-848/15116642 has 1 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-848/15116642?
The CAS number of AE-848/15116642 is 370844-83-0.
What is the molecular formula of AE-848/15116642?
The molecular formula of AE-848/15116642 is C26H21N3O2S.
What is the molecular weight of AE-848/15116642?
The molecular weight of AE-848/15116642 is 439.14 g/mol.
Where can I buy AE-848/15116642?
You can request a quote for AE-848/15116642 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/15116642?
Yes, KEHONG BIO provides custom synthesis services for AE-848/15116642 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.