(E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester
TL;DR: (E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester (CAS 374545-27-4) is a chemical compound with molecular formula C23H17BrFN3O5 and molecular weight 513.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-bromo-2-[(E)-[[2-[(3-fluorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] (E)-3-(furan-2-yl)prop-2-enoate
Also Known As: (E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester, (E)-4-bromo-2-((E)-(2-(2-(3-fluorobenzamido)acetyl)hydrazono)methyl)phenyl 3-(furan-2-yl)acrylate, 4-bromo-2-{(E)-[2-({[(3-fluorophenyl)carbonyl]amino}acetyl)hydrazinylidene]methyl}phenyl (2E)-3-(furan-2-yl)prop-2-enoate (non-preferred name)
| Molecular Formula | C23H17BrFN3O5 |
|---|---|
| Molecular Weight | 513.03 g/mol |
| LogP | 3.6801 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 513.03357 |
| Heavy Atoms | 33 |
| Complexity | 1208.5658 |
Chemical Identifiers
| CAS Number | 374545-27-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)C(=O)NCC(=O)N/N=C/C2=C(C=CC(=C2)Br)OC(=O)/C=C/C3=CC=CO3 |
Product Overview
(E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester (CAS 374545-27-4), with molecular formula C23H17BrFN3O5 and molecular weight 513.03 g/mol. IUPAC: [4-bromo-2-[(E)-[[2-[(3-fluorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] (E)-3-(furan-2-yl)prop-2-enoate.
Chemical Property Profile of (E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester
Property Insights of (E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester
The XLogP value of 3.6801 indicates that (E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester. Following Lipinski's Rule of Five, (E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester?
The CAS number of (E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester is 374545-27-4.
What is the molecular formula of (E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester?
The molecular formula of (E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester is C23H17BrFN3O5.
What is the molecular weight of (E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester?
The molecular weight of (E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester is 513.03 g/mol.
Where can I buy (E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester?
You can request a quote for (E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-Furan-2-yl-acrylic acid 4-bromo-2-{[2-(3-fluoro-benzoylamino)-acetyl]-hydrazonomethyl}-phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.