RefChem:233634
TL;DR: RefChem:233634 (CAS 4482-17-1) is a chemical compound with molecular formula C16H20N4O4S and molecular weight 364.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-oxo-2-[(3-thiophen-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperazine-1-carboxylate
Also Known As: Ethyl 4-(2-oxo-2-((3-(2-thienyl)-5-isoxazolyl)amino)ethyl)-1-piperazinecarboxylate, 1-Piperazinecarboxylic acid, 4-(2-oxo-2-((3-(2-thienyl)-5-isoxazolyl)amino)ethyl)-, ethyl ester, ethyl 4-(2-oxo-2-{[3-(thiophen-2-yl)-1,2-oxazol-5-yl]amino}ethyl)piperazine-1-carboxylate, ethyl 4-[2-oxo-2-[(3-thiophen-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperazine-1-carboxylate, Ethyl 4-(2-oxo-2-((3-(thiophen-2-yl)isoxazol-5-yl)amino)ethyl)piperazine-1-carboxylate
| Molecular Formula | C16H20N4O4S |
|---|---|
| Molecular Weight | 364.12 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 364.1205 |
| Heavy Atoms | 25 |
| Complexity | 473.0 |
Chemical Identifiers
| CAS Number | 4482-17-1 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)CC(=O)NC2=CC(=NO2)C3=CC=CS3 |
| InChIKey | DFVMCCHWEAGSDM-UHFFFAOYSA-N |
Product Overview
RefChem:233634 (CAS 4482-17-1), with molecular formula C16H20N4O4S and molecular weight 364.12 g/mol. IUPAC: ethyl 4-[2-oxo-2-[(3-thiophen-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperazine-1-carboxylate.
Chemical Property Profile of RefChem:233634
Property Insights of RefChem:233634
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:233634. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:233634. Following Lipinski's Rule of Five, RefChem:233634 has 1 hydrogen bond donor(s) and 7 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 RefChem:233634?
The CAS number of RefChem:233634 is 4482-17-1.
What is the molecular formula of RefChem:233634?
The molecular formula of RefChem:233634 is C16H20N4O4S.
What is the molecular weight of RefChem:233634?
The molecular weight of RefChem:233634 is 364.12 g/mol.
Where can I buy RefChem:233634?
You can request a quote for RefChem:233634 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:233634?
Yes, KEHONG BIO provides custom synthesis services for RefChem:233634 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.