![Ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate structure](/static/products/7745/774589-17-2.webp)
Ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate
TL;DR: Ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate (CAS 774589-17-2) is a chemical compound with molecular formula C11H14BrNO3S and molecular weight 318.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(4-bromo-5-ethylthiophene-2-carbonyl)amino]acetate
Also Known As: ethyl N-[(4-bromo-5-ethylthiophen-2-yl)carbonyl]glycinate, ethyl 2-(4-bromo-5-ethylthiophene-2-carboxamido)acetate, ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate, ethyl 2-[(4-bromo-5-ethylthiophene-2-carbonyl)amino]acetate, ETHYL 2-{[(4-BROMO-5-ETHYL-2-THIENYL)CARBONYL]AMINO}ACETATE
| Molecular Formula | C11H14BrNO3S |
|---|---|
| Molecular Weight | 318.99 g/mol |
| LogP | 2.3659 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.9878 |
| Heavy Atoms | 17 |
| Complexity | 416.8491 |
Chemical Identifiers
| CAS Number | 774589-17-2 |
|---|---|
| SMILES | CCC1=C(C=C(S1)C(=O)NCC(=O)OCC)Br |
Product Overview
Ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate (CAS 774589-17-2), with molecular formula C11H14BrNO3S and molecular weight 318.99 g/mol. IUPAC: ethyl 2-[(4-bromo-5-ethylthiophene-2-carbonyl)amino]acetate.
Chemical Property Profile of Ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate
Property Insights of Ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate
The XLogP value of 2.3659 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate. With a topological polar surface area (TPSA) of 55.4 Ų, Ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate has 1 hydrogen bond donor(s) and 4 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-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate?
The CAS number of Ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate is 774589-17-2.
What is the molecular formula of Ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate?
The molecular formula of Ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate is C11H14BrNO3S.
What is the molecular weight of Ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate?
The molecular weight of Ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate is 318.99 g/mol.
Where can I buy Ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate?
You can request a quote for Ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[(4-bromo-5-ethyl-2-thienyl)carbonylamino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.