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Ethyl 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate
TL;DR: Ethyl 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate (CAS 712348-18-0) is a chemical compound with molecular formula C18H20N2O4 and molecular weight 328.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-3-carboxylate
Also Known As: BAS 09529724, AN-329/43211332, ethyl 1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-3-carboxylate, ethyl 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate, ethyl 1-(5-phenylisoxazole-3-carbonyl)piperidine-3-carboxylate
| Molecular Formula | C18H20N2O4 |
|---|---|
| Molecular Weight | 328.14 g/mol |
| LogP | 2.7569 |
| Topological Polar Surface Area | 72.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.1423 |
| Heavy Atoms | 24 |
| Complexity | 710.81866 |
Chemical Identifiers
| CAS Number | 712348-18-0 |
|---|---|
| SMILES | CCOC(=O)C1CCCN(C1)C(=O)C2=NOC(=C2)C3=CC=CC=C3 |
Product Overview
Ethyl 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate (CAS 712348-18-0), with molecular formula C18H20N2O4 and molecular weight 328.14 g/mol. IUPAC: ethyl 1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-3-carboxylate.
Chemical Property Profile of Ethyl 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate
Property Insights of Ethyl 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate
The XLogP value of 2.7569 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate. The TPSA of 72.64 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate. Following Lipinski's Rule of Five, Ethyl 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate 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 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate?
The CAS number of Ethyl 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate is 712348-18-0.
What is the molecular formula of Ethyl 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate?
The molecular formula of Ethyl 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate is C18H20N2O4.
What is the molecular weight of Ethyl 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate?
The molecular weight of Ethyl 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate is 328.14 g/mol.
Where can I buy Ethyl 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate?
You can request a quote for Ethyl 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-[(5-phenyl-3-isoxazolyl)carbonyl]-3-piperidinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.