2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate
TL;DR: 2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate (CAS 356090-19-2) is a chemical compound with molecular formula C22H19NO5S and molecular weight 409.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxo-2-thiophen-2-ylethyl) 4-oxo-4-(4-phenoxyanilino)butanoate
Also Known As: 2-oxo-2-(2-thienyl)ethyl 4-oxo-4-(4-phenoxyanilino)butanoate, (2-oxo-2-thiophen-2-ylethyl) 4-oxo-4-(4-phenoxyanilino)butanoate, 2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate, 2-oxo-2-(thiophen-2-yl)ethyl 4-oxo-4-((4-phenoxyphenyl)amino)butanoate, 2-oxo-2-(thiophen-2-yl)ethyl 4-oxo-4-[(4-phenoxyphenyl)amino]butanoate
| Molecular Formula | C22H19NO5S |
|---|---|
| Molecular Weight | 409.10 g/mol |
| LogP | 4.6852 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 409.0984 |
| Heavy Atoms | 29 |
| Complexity | 952.63727 |
Chemical Identifiers
| CAS Number | 356090-19-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCC(=O)OCC(=O)C3=CC=CS3 |
Product Overview
2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate (CAS 356090-19-2), with molecular formula C22H19NO5S and molecular weight 409.10 g/mol. IUPAC: (2-oxo-2-thiophen-2-ylethyl) 4-oxo-4-(4-phenoxyanilino)butanoate.
Chemical Property Profile of 2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate
Property Insights of 2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate
The XLogP value of 4.6852 indicates that 2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate. Following Lipinski's Rule of Five, 2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate has 1 hydrogen bond donor(s) and 6 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 2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate?
The CAS number of 2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate is 356090-19-2.
What is the molecular formula of 2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate?
The molecular formula of 2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate is C22H19NO5S.
What is the molecular weight of 2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate?
The molecular weight of 2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate is 409.10 g/mol.
Where can I buy 2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate?
You can request a quote for 2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-oxo-2-(2-thienyl)ethyl 3-[N-(4-phenoxyphenyl)carbamoyl]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.