AE-848/11419077
TL;DR: AE-848/11419077 (CAS 325729-96-2) is a chemical compound with molecular formula C22H20BrNO4S and molecular weight 473.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-bromophenyl)-2-[[2-(2-methylphenoxy)acetyl]amino]thiophene-3-carboxylate
Also Known As: AE-848/11419077, ethyl 4-(4-bromophenyl)-2-[[2-(2-methylphenoxy)acetyl]amino]thiophene-3-carboxylate, ethyl 4-(4-bromophenyl)-2-{[(2-methylphenoxy)acetyl]amino}-3-thiophenecarboxylate, ethyl 4-(4-bromophenyl)-2-(2-(o-tolyloxy)acetamido)thiophene-3-carboxylate, ethyl 4-(4-bromophenyl)-2-{[(2-methylphenoxy)acetyl]amino}thiophene-3-carboxylate
| Molecular Formula | C22H20BrNO4S |
|---|---|
| Molecular Weight | 473.03 g/mol |
| LogP | 5.68022 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 473.02963 |
| Heavy Atoms | 29 |
| Complexity | 1013.9067 |
Chemical Identifiers
| CAS Number | 325729-96-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)COC3=CC=CC=C3C |
Product Overview
AE-848/11419077 (CAS 325729-96-2), with molecular formula C22H20BrNO4S and molecular weight 473.03 g/mol. IUPAC: ethyl 4-(4-bromophenyl)-2-[[2-(2-methylphenoxy)acetyl]amino]thiophene-3-carboxylate.
Chemical Property Profile of AE-848/11419077
Property Insights of AE-848/11419077
The XLogP value of 5.68022 indicates that AE-848/11419077 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/11419077. Following Lipinski's Rule of Five, AE-848/11419077 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-848/11419077?
The CAS number of AE-848/11419077 is 325729-96-2.
What is the molecular formula of AE-848/11419077?
The molecular formula of AE-848/11419077 is C22H20BrNO4S.
What is the molecular weight of AE-848/11419077?
The molecular weight of AE-848/11419077 is 473.03 g/mol.
Where can I buy AE-848/11419077?
You can request a quote for AE-848/11419077 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/11419077?
Yes, KEHONG BIO provides custom synthesis services for AE-848/11419077 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.