Ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate
TL;DR: Ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate (CAS 708223-74-9) is a chemical compound with molecular formula C18H27NO4S and molecular weight 353.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate
Also Known As: AP-263/42373688, ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate, ethyl 1-[(4-tert-butylphenyl)sulfonyl]-3-piperidinecarboxylate, ethyl 1-((4-(tert-butyl)phenyl)sulfonyl)piperidine-3-carboxylate, ethyl 1-{[4-(tert-butyl)phenyl]sulfonyl}piperidine-3-carboxylate
| Molecular Formula | C18H27NO4S |
|---|---|
| Molecular Weight | 353.17 g/mol |
| LogP | 2.9479 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 353.16608 |
| Heavy Atoms | 24 |
| Complexity | 673.96545 |
Chemical Identifiers
| CAS Number | 708223-74-9 |
|---|---|
| SMILES | CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C |
Product Overview
Ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate (CAS 708223-74-9), with molecular formula C18H27NO4S and molecular weight 353.17 g/mol. IUPAC: ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate.
Chemical Property Profile of Ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate
Property Insights of Ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate
The XLogP value of 2.9479 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate has 0 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 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate?
The CAS number of Ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate is 708223-74-9.
What is the molecular formula of Ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate?
The molecular formula of Ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate is C18H27NO4S.
What is the molecular weight of Ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate?
The molecular weight of Ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate is 353.17 g/mol.
Where can I buy Ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate?
You can request a quote for Ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-(4-tert-butylphenyl)sulfonylpiperidine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.