Ethyl 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate
TL;DR: Ethyl 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate (CAS 339348-10-6) is a chemical compound with molecular formula C15H21NO4 and molecular weight 279.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-amino-4-oxo-3-(4-propan-2-yloxyphenyl)butanoate
Also Known As: ethyl 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate, ethyl 4-amino-4-oxo-3-(4-propan-2-yloxyphenyl)butanoate
| Molecular Formula | C15H21NO4 |
|---|---|
| Molecular Weight | 279.15 g/mol |
| LogP | 1.9959 |
| Topological Polar Surface Area | 78.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 279.14706 |
| Heavy Atoms | 20 |
| Complexity | 453.44626 |
Chemical Identifiers
| CAS Number | 339348-10-6 |
|---|---|
| SMILES | CCOC(=O)CC(C1=CC=C(C=C1)OC(C)C)C(=O)N |
Product Overview
Ethyl 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate (CAS 339348-10-6), with molecular formula C15H21NO4 and molecular weight 279.15 g/mol. IUPAC: ethyl 4-amino-4-oxo-3-(4-propan-2-yloxyphenyl)butanoate.
Chemical Property Profile of Ethyl 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate
Property Insights of Ethyl 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate
The XLogP value of 1.9959 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate. The TPSA of 78.62 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate. Following Lipinski's Rule of Five, Ethyl 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate has 1 hydrogen bond donor(s) and 4 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 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate?
The CAS number of Ethyl 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate is 339348-10-6.
What is the molecular formula of Ethyl 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate?
The molecular formula of Ethyl 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate is C15H21NO4.
What is the molecular weight of Ethyl 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate?
The molecular weight of Ethyl 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate is 279.15 g/mol.
Where can I buy Ethyl 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate?
You can request a quote for Ethyl 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-amino-3-(4-isopropoxyphenyl)-4-oxobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.