Ethyl {[2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}acetate
TL;DR: Ethyl {[2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}acetate (CAS 304880-87-3) is a chemical compound with molecular formula C18H16Br2N2O5 and molecular weight 497.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[(E)-2-[(5-bromofuran-2-carbonyl)amino]-3-(4-bromophenyl)prop-2-enoyl]amino]acetate
Also Known As: BAS 00386045, (E)-ethyl 2-(2-(5-bromofuran-2-carboxamido)-3-(4-bromophenyl)acrylamido)acetate, ethyl {[2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}acetate, ethyl 2-[(2E)-2-[(5-bromofuran-2-yl)formamido]-3-(4-bromophenyl)prop-2-enamido]acetate, ethyl 2-[[(E)-2-[(5-bromofuran-2-carbonyl)amino]-3-(4-bromophenyl)prop-2-enoyl]amino]acetate
| Molecular Formula | C18H16Br2N2O5 |
|---|---|
| Molecular Weight | 497.94 g/mol |
| LogP | 3.2548 |
| Topological Polar Surface Area | 97.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 497.9426 |
| Heavy Atoms | 27 |
| Complexity | 858.89185 |
Chemical Identifiers
| CAS Number | 304880-87-3 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)/C(=C\C1=CC=C(C=C1)Br)/NC(=O)C2=CC=C(O2)Br |
Product Overview
Ethyl {[2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}acetate (CAS 304880-87-3), with molecular formula C18H16Br2N2O5 and molecular weight 497.94 g/mol. IUPAC: ethyl 2-[[(E)-2-[(5-bromofuran-2-carbonyl)amino]-3-(4-bromophenyl)prop-2-enoyl]amino]acetate.
Chemical Property Profile of Ethyl {[2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}acetate
Property Insights of Ethyl {[2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}acetate
The XLogP value of 3.2548 indicates that Ethyl {[2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.64 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl {[2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}acetate. Following Lipinski's Rule of Five, Ethyl {[2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}acetate has 2 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-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}acetate?
The CAS number of Ethyl {[2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}acetate is 304880-87-3.
What is the molecular formula of Ethyl {[2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}acetate?
The molecular formula of Ethyl {[2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}acetate is C18H16Br2N2O5.
What is the molecular weight of Ethyl {[2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}acetate?
The molecular weight of Ethyl {[2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}acetate is 497.94 g/mol.
Where can I buy Ethyl {[2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}acetate?
You can request a quote for Ethyl {[2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}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-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl {[2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]amino}acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.