Ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate
TL;DR: Ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate (CAS 352549-72-5) is a chemical compound with molecular formula C15H16BrNO4S and molecular weight 385.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-acetamido-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate
Also Known As: ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate, AH-262/32338026, ethyl 2-acetamido-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate, ethyl 2-acetamido-6-bromo-7-ethoxybenzo[b]thiophene-3-carboxylate, ETHYL 6-BROMO-2-ACETAMIDO-7-ETHOXY-1-BENZOTHIOPHENE-3-CARBOXYLATE
| Molecular Formula | C15H16BrNO4S |
|---|---|
| Molecular Weight | 385.00 g/mol |
| LogP | 4.1976 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 384.99835 |
| Heavy Atoms | 22 |
| Complexity | 725.891 |
Chemical Identifiers
| CAS Number | 352549-72-5 |
|---|---|
| SMILES | CCOC1=C(C=CC2=C1SC(=C2C(=O)OCC)NC(=O)C)Br |
Product Overview
Ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate (CAS 352549-72-5), with molecular formula C15H16BrNO4S and molecular weight 385.00 g/mol. IUPAC: ethyl 2-acetamido-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate.
Chemical Property Profile of Ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate
Property Insights of Ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate
The XLogP value of 4.1976 indicates that Ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate 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 Ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate 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 Ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate?
The CAS number of Ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate is 352549-72-5.
What is the molecular formula of Ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate?
The molecular formula of Ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate is C15H16BrNO4S.
What is the molecular weight of Ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate?
The molecular weight of Ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate is 385.00 g/mol.
Where can I buy Ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate?
You can request a quote for Ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(acetylamino)-6-bromo-7-ethoxy-1-benzothiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.