Ethyl 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate
TL;DR: Ethyl 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate (CAS 338415-02-4) is a chemical compound with molecular formula C16H21NO3 and molecular weight 275.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(3,3-dimethyl-2-oxoazetidin-1-yl)-3-phenylpropanoate
Also Known As: ethyl 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate, ethyl 2-(3,3-dimethyl-2-oxoazetidin-1-yl)-3-phenylpropanoate, 3M-737, ethyl2-(3,3-dimethyl-2-oxoazetidin-1-yl)-3-phenylpropanoate, Ethyl 2-(3,3-dimethyl-2-oxo-azetidin-1-yl)-3-phenyl-propanoate
| Molecular Formula | C16H21NO3 |
|---|---|
| Molecular Weight | 275.15 g/mol |
| LogP | 2.0292 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 275.15213 |
| Heavy Atoms | 20 |
| Complexity | 495.70328 |
Chemical Identifiers
| CAS Number | 338415-02-4 |
|---|---|
| SMILES | CCOC(=O)C(CC1=CC=CC=C1)N2CC(C2=O)(C)C |
Product Overview
Ethyl 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate (CAS 338415-02-4), with molecular formula C16H21NO3 and molecular weight 275.15 g/mol. IUPAC: ethyl 2-(3,3-dimethyl-2-oxoazetidin-1-yl)-3-phenylpropanoate.
Chemical Property Profile of Ethyl 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate
Property Insights of Ethyl 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate
The XLogP value of 2.0292 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate. With a topological polar surface area (TPSA) of 46.61 Ų, Ethyl 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate 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 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate?
The CAS number of Ethyl 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate is 338415-02-4.
What is the molecular formula of Ethyl 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate?
The molecular formula of Ethyl 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate is C16H21NO3.
What is the molecular weight of Ethyl 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate?
The molecular weight of Ethyl 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate is 275.15 g/mol.
Where can I buy Ethyl 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate?
You can request a quote for Ethyl 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(3,3-dimethyl-2-oxo-1-azetanyl)-3-phenylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.