Ethyl N-acetyl-N-phenylglycinate
TL;DR: Ethyl N-acetyl-N-phenylglycinate (CAS 83949-33-1) 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-(N-acetylanilino)acetate
Also Known As: Ethyl N-acetyl-N-phenylglycinate, ethyl 2-(N-acetylanilino)acetate, ethylN-acetyl-N-phenylglycinate, Acetanilinoessigsaeure-aethylester, N-Acetyl-N-phenylglycine ethyl ester
| Molecular Formula | C12H15NO3 |
|---|---|
| Molecular Weight | 221.11 g/mol |
| LogP | 1.0 |
| 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 | 83949-33-1 |
|---|---|
| SMILES | CCOC(=O)CN(C1=CC=CC=C1)C(=O)C |
| InChIKey | TWDRHDKGILAXDB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl N-acetyl-N-phenylglycinate (CAS 83949-33-1), with molecular formula C12H15NO3 and molecular weight 221.11 g/mol. IUPAC: ethyl 2-(N-acetylanilino)acetate.
Chemical Property Profile of Ethyl N-acetyl-N-phenylglycinate
Property Insights of Ethyl N-acetyl-N-phenylglycinate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl N-acetyl-N-phenylglycinate. With a topological polar surface area (TPSA) of 46.6 Ų, Ethyl N-acetyl-N-phenylglycinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl N-acetyl-N-phenylglycinate 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-acetyl-N-phenylglycinate?
The CAS number of Ethyl N-acetyl-N-phenylglycinate is 83949-33-1.
What is the molecular formula of Ethyl N-acetyl-N-phenylglycinate?
The molecular formula of Ethyl N-acetyl-N-phenylglycinate is C12H15NO3.
What is the molecular weight of Ethyl N-acetyl-N-phenylglycinate?
The molecular weight of Ethyl N-acetyl-N-phenylglycinate is 221.11 g/mol.
Where can I buy Ethyl N-acetyl-N-phenylglycinate?
You can request a quote for Ethyl N-acetyl-N-phenylglycinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl N-acetyl-N-phenylglycinate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl N-acetyl-N-phenylglycinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.