ethyl N-benzyl-N-methyloxamate
TL;DR: ethyl N-benzyl-N-methyloxamate (CAS 128429-34-5) is a chemical compound with molecular formula C12H15NO3 and molecular weight 221.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[benzyl(methyl)amino]-2-oxoacetate
Also Known As: EBMO, Ethyl N-benzyl-N-methyloxamate, Ethyl N-N-benzyl-methyl-oxamate, ethyl 2-[benzyl(methyl)amino]-2-oxoacetate, ethyl N-methyl-N-benzyl-oxamate
| Molecular Formula | C12H15NO3 |
|---|---|
| Molecular Weight | 221.11 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 221.1052 |
| Heavy Atoms | 16 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 128429-34-5 |
|---|---|
| SMILES | CCOC(=O)C(=O)N(C)CC1=CC=CC=C1 |
| InChIKey | XYKZEJYMLKSOGC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
ethyl N-benzyl-N-methyloxamate (CAS 128429-34-5), with molecular formula C12H15NO3 and molecular weight 221.11 g/mol. IUPAC: ethyl 2-[benzyl(methyl)amino]-2-oxoacetate.
Chemical Property Profile of ethyl N-benzyl-N-methyloxamate
Property Insights of ethyl N-benzyl-N-methyloxamate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-benzyl-N-methyloxamate. With a topological polar surface area (TPSA) of 46.6 Ų, ethyl N-benzyl-N-methyloxamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl N-benzyl-N-methyloxamate has 0 hydrogen bond donor(s) and 3 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 N-benzyl-N-methyloxamate?
The CAS number of ethyl N-benzyl-N-methyloxamate is 128429-34-5.
What is the molecular formula of ethyl N-benzyl-N-methyloxamate?
The molecular formula of ethyl N-benzyl-N-methyloxamate is C12H15NO3.
What is the molecular weight of ethyl N-benzyl-N-methyloxamate?
The molecular weight of ethyl N-benzyl-N-methyloxamate is 221.11 g/mol.
Where can I buy ethyl N-benzyl-N-methyloxamate?
You can request a quote for ethyl N-benzyl-N-methyloxamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl N-benzyl-N-methyloxamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-benzyl-N-methyloxamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.