Ethyl 2-(((5-bromo-2-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)amino)acetate
TL;DR: Ethyl 2-(((5-bromo-2-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)amino)acetate (CAS 312758-76-2) is a chemical compound with molecular formula C20H23BrN2O4 and molecular weight 434.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[[5-bromo-2-(ethoxycarbonylamino)phenyl]-phenylmethyl]amino]acetate
Also Known As: BAS 00462511, AH-034/34967027, ethyl 2-(((5-bromo-2-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)amino)acetate, ethyl N-[{5-bromo-2-[(ethoxycarbonyl)amino]phenyl}(phenyl)methyl]glycinate, {[(5-Bromo-2-ethoxycarbonylamino-phenyl)-phenyl-methyl]-amino}-acetic acid ethyl ester
| Molecular Formula | C20H23BrN2O4 |
|---|---|
| Molecular Weight | 434.08 g/mol |
| LogP | 4.2596 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 434.0841 |
| Heavy Atoms | 27 |
| Complexity | 767.832 |
Chemical Identifiers
| CAS Number | 312758-76-2 |
|---|---|
| SMILES | CCOC(=O)CNC(C1=CC=CC=C1)C2=C(C=CC(=C2)Br)NC(=O)OCC |
Product Overview
Ethyl 2-(((5-bromo-2-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)amino)acetate (CAS 312758-76-2), with molecular formula C20H23BrN2O4 and molecular weight 434.08 g/mol. IUPAC: ethyl 2-[[[5-bromo-2-(ethoxycarbonylamino)phenyl]-phenylmethyl]amino]acetate.
Chemical Property Profile of Ethyl 2-(((5-bromo-2-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)amino)acetate
Property Insights of Ethyl 2-(((5-bromo-2-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)amino)acetate
The XLogP value of 4.2596 indicates that Ethyl 2-(((5-bromo-2-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)amino)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(((5-bromo-2-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)amino)acetate. Following Lipinski's Rule of Five, Ethyl 2-(((5-bromo-2-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)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-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)amino)acetate?
The CAS number of Ethyl 2-(((5-bromo-2-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)amino)acetate is 312758-76-2.
What is the molecular formula of Ethyl 2-(((5-bromo-2-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)amino)acetate?
The molecular formula of Ethyl 2-(((5-bromo-2-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)amino)acetate is C20H23BrN2O4.
What is the molecular weight of Ethyl 2-(((5-bromo-2-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)amino)acetate?
The molecular weight of Ethyl 2-(((5-bromo-2-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)amino)acetate is 434.08 g/mol.
Where can I buy Ethyl 2-(((5-bromo-2-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)amino)acetate?
You can request a quote for Ethyl 2-(((5-bromo-2-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)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-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)amino)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(((5-bromo-2-((ethoxycarbonyl)amino)phenyl)(phenyl)methyl)amino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.