AE-848/12124584
TL;DR: AE-848/12124584 (CAS 380643-88-9) is a chemical compound with molecular formula C21H27NO4S and molecular weight 389.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-ethyl-2-[[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]amino]thiophene-3-carboxylate
Also Known As: AE-848/12124584, ethyl 5-ethyl-2-(2-(2-isopropyl-5-methylphenoxy)acetamido)thiophene-3-carboxylate, ethyl 5-ethyl-2-[[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]amino]thiophene-3-carboxylate, ethyl 5-ethyl-2-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}-3-thiophenecarboxylate, ethyl 5-ethyl-2-({[5-methyl-2-(propan-2-yl)phenoxy]acetyl}amino)thiophene-3-carboxylate
| Molecular Formula | C21H27NO4S |
|---|---|
| Molecular Weight | 389.17 g/mol |
| LogP | 4.93652 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 389.16608 |
| Heavy Atoms | 27 |
| Complexity | 810.5081 |
Chemical Identifiers
| CAS Number | 380643-88-9 |
|---|---|
| SMILES | CCC1=CC(=C(S1)NC(=O)COC2=C(C=CC(=C2)C)C(C)C)C(=O)OCC |
Product Overview
AE-848/12124584 (CAS 380643-88-9), with molecular formula C21H27NO4S and molecular weight 389.17 g/mol. IUPAC: ethyl 5-ethyl-2-[[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]amino]thiophene-3-carboxylate.
Chemical Property Profile of AE-848/12124584
Property Insights of AE-848/12124584
The XLogP value of 4.93652 indicates that AE-848/12124584 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-848/12124584. Following Lipinski's Rule of Five, AE-848/12124584 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AE-848/12124584?
The CAS number of AE-848/12124584 is 380643-88-9.
What is the molecular formula of AE-848/12124584?
The molecular formula of AE-848/12124584 is C21H27NO4S.
What is the molecular weight of AE-848/12124584?
The molecular weight of AE-848/12124584 is 389.17 g/mol.
Where can I buy AE-848/12124584?
You can request a quote for AE-848/12124584 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/12124584?
Yes, KEHONG BIO provides custom synthesis services for AE-848/12124584 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.