Diethyl 2-acetamido-2-phenethylmalonate
TL;DR: Diethyl 2-acetamido-2-phenethylmalonate (CAS 63217-15-2) is a chemical compound with molecular formula C17H23NO5 and molecular weight 321.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-acetamido-2-(2-phenylethyl)propanedioate
Also Known As: Diethyl 2-acetamido-2-phenethylmalonate, diethyl (acetylamino)(2-phenylethyl)malonate, Diethyl2-acetamido-2-phenethylmalonate, diethyl 2-acetamido-2-(2-phenylethyl)propanedioate, 7918AB
| Molecular Formula | C17H23NO5 |
|---|---|
| Molecular Weight | 321.16 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 321.15762 |
| Heavy Atoms | 23 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 63217-15-2 |
|---|---|
| SMILES | CCOC(=O)C(CCC1=CC=CC=C1)(C(=O)OCC)NC(=O)C |
| InChIKey | VRDSDOBEYJYDLA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diethyl 2-acetamido-2-phenethylmalonate (CAS 63217-15-2), with molecular formula C17H23NO5 and molecular weight 321.16 g/mol. IUPAC: diethyl 2-acetamido-2-(2-phenylethyl)propanedioate.
Chemical Property Profile of Diethyl 2-acetamido-2-phenethylmalonate
Property Insights of Diethyl 2-acetamido-2-phenethylmalonate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 2-acetamido-2-phenethylmalonate. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2-acetamido-2-phenethylmalonate. Following Lipinski's Rule of Five, Diethyl 2-acetamido-2-phenethylmalonate has 1 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 Diethyl 2-acetamido-2-phenethylmalonate?
The CAS number of Diethyl 2-acetamido-2-phenethylmalonate is 63217-15-2.
What is the molecular formula of Diethyl 2-acetamido-2-phenethylmalonate?
The molecular formula of Diethyl 2-acetamido-2-phenethylmalonate is C17H23NO5.
What is the molecular weight of Diethyl 2-acetamido-2-phenethylmalonate?
The molecular weight of Diethyl 2-acetamido-2-phenethylmalonate is 321.16 g/mol.
Where can I buy Diethyl 2-acetamido-2-phenethylmalonate?
You can request a quote for Diethyl 2-acetamido-2-phenethylmalonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2-acetamido-2-phenethylmalonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-acetamido-2-phenethylmalonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.