![[2-(4-Bromophenyl)-2-hydroxyacetylamino]acetic acid, ethyl ester structure](/static/products/112/112681-27-3.png)
[2-(4-Bromophenyl)-2-hydroxyacetylamino]acetic acid, ethyl ester
TL;DR: [2-(4-Bromophenyl)-2-hydroxyacetylamino]acetic acid, ethyl ester (CAS 112681-27-3) is a chemical compound with molecular formula C12H14BrNO4 and molecular weight 315.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(4-bromophenyl)-2-hydroxyacetyl]amino]acetate
Also Known As: rac-N-(hydroxy(4-bromophenyl)acetyl)glycine ethyl ester, Ethyl ([(4-bromophenyl)(hydroxy)acetyl]amino)acetate, Ethyl ([(4-bromophenyl)(hydroxy)acetyl]amino)acetate #, ethyl 2-[[2-(4-bromophenyl)-2-hydroxyacetyl]amino]acetate, [2-(4-Bromophenyl)-2-hydroxyacetylamino]acetic acid, ethyl ester
| Molecular Formula | C12H14BrNO4 |
|---|---|
| Molecular Weight | 315.01 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 315.01062 |
| Heavy Atoms | 18 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 112681-27-3 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)C(C1=CC=C(C=C1)Br)O |
| InChIKey | DTASLYNLSOSWQS-UHFFFAOYSA-N |
Product Overview
[2-(4-Bromophenyl)-2-hydroxyacetylamino]acetic acid, ethyl ester (CAS 112681-27-3), with molecular formula C12H14BrNO4 and molecular weight 315.01 g/mol. IUPAC: ethyl 2-[[2-(4-bromophenyl)-2-hydroxyacetyl]amino]acetate.
Chemical Property Profile of [2-(4-Bromophenyl)-2-hydroxyacetylamino]acetic acid, ethyl ester
Property Insights of [2-(4-Bromophenyl)-2-hydroxyacetylamino]acetic acid, ethyl ester
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(4-Bromophenyl)-2-hydroxyacetylamino]acetic acid, ethyl ester. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(4-Bromophenyl)-2-hydroxyacetylamino]acetic acid, ethyl ester. Following Lipinski's Rule of Five, [2-(4-Bromophenyl)-2-hydroxyacetylamino]acetic acid, ethyl ester has 2 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-hydroxyacetylamino]acetic acid, ethyl ester?
The CAS number of [2-(4-Bromophenyl)-2-hydroxyacetylamino]acetic acid, ethyl ester is 112681-27-3.
What is the molecular formula of [2-(4-Bromophenyl)-2-hydroxyacetylamino]acetic acid, ethyl ester?
The molecular formula of [2-(4-Bromophenyl)-2-hydroxyacetylamino]acetic acid, ethyl ester is C12H14BrNO4.
What is the molecular weight of [2-(4-Bromophenyl)-2-hydroxyacetylamino]acetic acid, ethyl ester?
The molecular weight of [2-(4-Bromophenyl)-2-hydroxyacetylamino]acetic acid, ethyl ester is 315.01 g/mol.
Where can I buy [2-(4-Bromophenyl)-2-hydroxyacetylamino]acetic acid, ethyl ester?
You can request a quote for [2-(4-Bromophenyl)-2-hydroxyacetylamino]acetic acid, ethyl ester 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-hydroxyacetylamino]acetic acid, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for [2-(4-Bromophenyl)-2-hydroxyacetylamino]acetic acid, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.