![[2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate structure](/static/products/5281/5281-14-1.webp)
[2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate
TL;DR: [2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate (CAS 5281-14-1) is a chemical compound with molecular formula C17H14BrNO4 and molecular weight 375.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-bromophenyl)-2-oxoethyl] 2-benzamidoacetate
Also Known As: 4-Bromophenacyl hippurate, 2-(4-bromophenyl)-2-oxoethyl N-benzoylglycinate, BAS 00293896, [2-(4-bromophenyl)-2-oxoethyl] 2-benzamidoacetate, J1.396.523D
| Molecular Formula | C17H14BrNO4 |
|---|---|
| Molecular Weight | 375.01 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 72.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 375.01062 |
| Heavy Atoms | 23 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 5281-14-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NCC(=O)OCC(=O)C2=CC=C(C=C2)Br |
| InChIKey | WAZLICIMDYSWGL-UHFFFAOYSA-N |
Product Overview
[2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate (CAS 5281-14-1), with molecular formula C17H14BrNO4 and molecular weight 375.01 g/mol. IUPAC: [2-(4-bromophenyl)-2-oxoethyl] 2-benzamidoacetate.
Chemical Property Profile of [2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate
Property Insights of [2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate
The XLogP value of 3.2 indicates that [2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.5 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate. Following Lipinski's Rule of Five, [2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate 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 [2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate?
The CAS number of [2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate is 5281-14-1.
What is the molecular formula of [2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate?
The molecular formula of [2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate is C17H14BrNO4.
What is the molecular weight of [2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate?
The molecular weight of [2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate is 375.01 g/mol.
Where can I buy [2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate?
You can request a quote for [2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate?
Yes, KEHONG BIO provides custom synthesis services for [2-(4-Bromophenyl)-2-oxoethyl] 2-benzamidoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.