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Ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate
TL;DR: Ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate (CAS 3619-66-7) is a chemical compound with molecular formula C14H27NO4 and molecular weight 273.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate
Also Known As: ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate, Diethyl 3,3'-(butylazanediyl)dipropanoate, J2.076.557G, 3,3'-Butylimino-di-propionsaeure-diaethylester, diethyl 3,3'-(butylimino)dipropanoate(non-preferred name)
| Molecular Formula | C14H27NO4 |
|---|---|
| Molecular Weight | 273.19 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 273.194 |
| Heavy Atoms | 19 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 3619-66-7 |
|---|---|
| SMILES | CCCCN(CCC(=O)OCC)CCC(=O)OCC |
| InChIKey | BBLPVHVOBMMCDC-UHFFFAOYSA-N |
Product Overview
Ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate (CAS 3619-66-7), with molecular formula C14H27NO4 and molecular weight 273.19 g/mol. IUPAC: ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate.
Chemical Property Profile of Ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate
Property Insights of Ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate. With a topological polar surface area (TPSA) of 55.8 Ų, Ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate has 0 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 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate?
The CAS number of Ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate is 3619-66-7.
What is the molecular formula of Ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate?
The molecular formula of Ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate is C14H27NO4.
What is the molecular weight of Ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate?
The molecular weight of Ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate is 273.19 g/mol.
Where can I buy Ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate?
You can request a quote for Ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-[butyl-(3-ethoxy-3-oxopropyl)amino]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.