AE-848/37031134
TL;DR: AE-848/37031134 (CAS 342593-01-5) is a chemical compound with molecular formula C24H11ClN4O4S and molecular weight 486.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(2-chloroquinolin-3-yl)-2-[4-(6-nitro-2-oxochromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Also Known As: AE-848/37031134, (E)-3-(2-chloroquinolin-3-yl)-2-[4-(6-nitro-2-oxochromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile, 3-(2-chloro-3-quinolinyl)-2-(4-{6-nitro-2-oxo-2H-chromen-3-yl}-1,3-thiazol-2-yl)acrylonitrile, (2E)-3-(2-chloroquinolin-3-yl)-2-[4-(6-nitro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile, (E)-3-(2-chloroquinolin-3-yl)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)acrylonitrile
| Molecular Formula | C24H11ClN4O4S |
|---|---|
| Molecular Weight | 486.02 g/mol |
| LogP | 6.09048 |
| Topological Polar Surface Area | 122.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 486.01895 |
| Heavy Atoms | 34 |
| Complexity | 1750.0847 |
Chemical Identifiers
| CAS Number | 342593-01-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C(=N2)Cl)/C=C(\C#N)/C3=NC(=CS3)C4=CC5=C(C=CC(=C5)[N+](=O)[O-])OC4=O |
Product Overview
AE-848/37031134 (CAS 342593-01-5), with molecular formula C24H11ClN4O4S and molecular weight 486.02 g/mol. IUPAC: (E)-3-(2-chloroquinolin-3-yl)-2-[4-(6-nitro-2-oxochromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile.
Chemical Property Profile of AE-848/37031134
Property Insights of AE-848/37031134
The XLogP value of 6.09048 indicates that AE-848/37031134 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.92 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/37031134. Following Lipinski's Rule of Five, AE-848/37031134 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AE-848/37031134?
The CAS number of AE-848/37031134 is 342593-01-5.
What is the molecular formula of AE-848/37031134?
The molecular formula of AE-848/37031134 is C24H11ClN4O4S.
What is the molecular weight of AE-848/37031134?
The molecular weight of AE-848/37031134 is 486.02 g/mol.
Where can I buy AE-848/37031134?
You can request a quote for AE-848/37031134 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/37031134?
Yes, KEHONG BIO provides custom synthesis services for AE-848/37031134 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.