AE-848/15116597
TL;DR: AE-848/15116597 (CAS 369394-78-5) is a chemical compound with molecular formula C25H23N5OS and molecular weight 441.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-diamino-5-cyano-N-(2-methylphenyl)-4-(4-propan-2-ylphenyl)thieno[2,3-b]pyridine-2-carboxamide
Also Known As: AE-848/15116597, 3,6-diamino-5-cyano-N-(2-methylphenyl)-4-(4-propan-2-ylphenyl)thieno[2,3-b]pyridine-2-carboxamide, 3,6-diamino-5-cyano-4-(4-isopropylphenyl)-N-(2-methylphenyl)thieno[2,3-b]pyridine-2-carboxamide, 3,6-diamino-5-cyano-N-(2-methylphenyl)-4-[4-(propan-2-yl)phenyl]thieno[2,3-b]pyridine-2-carboxamide, 3,6-diamino-5-cyano-4-(4-isopropylphenyl)-N-(o-tolyl)thieno[2,3-b]pyridine-2-carboxamide
| Molecular Formula | C25H23N5OS |
|---|---|
| Molecular Weight | 441.16 g/mol |
| LogP | 5.6835 |
| Topological Polar Surface Area | 117.82 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 441.16232 |
| Heavy Atoms | 32 |
| Complexity | 1380.4674 |
Chemical Identifiers
| CAS Number | 369394-78-5 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)C2=C(C3=C(S2)N=C(C(=C3C4=CC=C(C=C4)C(C)C)C#N)N)N |
Product Overview
AE-848/15116597 (CAS 369394-78-5), with molecular formula C25H23N5OS and molecular weight 441.16 g/mol. IUPAC: 3,6-diamino-5-cyano-N-(2-methylphenyl)-4-(4-propan-2-ylphenyl)thieno[2,3-b]pyridine-2-carboxamide.
Chemical Property Profile of AE-848/15116597
Property Insights of AE-848/15116597
The XLogP value of 5.6835 indicates that AE-848/15116597 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.82 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/15116597. Following Lipinski's Rule of Five, AE-848/15116597 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AE-848/15116597?
The CAS number of AE-848/15116597 is 369394-78-5.
What is the molecular formula of AE-848/15116597?
The molecular formula of AE-848/15116597 is C25H23N5OS.
What is the molecular weight of AE-848/15116597?
The molecular weight of AE-848/15116597 is 441.16 g/mol.
Where can I buy AE-848/15116597?
You can request a quote for AE-848/15116597 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/15116597?
Yes, KEHONG BIO provides custom synthesis services for AE-848/15116597 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.