![Ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylate structure](/static/products/873/873589-34-5.png)
Ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylate
TL;DR: Ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylate (CAS 873589-34-5) is a chemical compound with molecular formula C16H22BrNO5S and molecular weight 419.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-(5-bromo-2-methoxy-4-methylphenyl)sulfonylpiperidine-4-carboxylate
Also Known As: ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylate, AP-263/43302150, ethyl 1-(5-bromo-2-methoxy-4-methylphenyl)sulfonylpiperidine-4-carboxylate, ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]piperidine-4-carboxylate
| Molecular Formula | C16H22BrNO5S |
|---|---|
| Molecular Weight | 419.04 g/mol |
| LogP | 2.72992 |
| Topological Polar Surface Area | 72.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 419.04022 |
| Heavy Atoms | 24 |
| Complexity | 711.4231 |
Chemical Identifiers
| CAS Number | 873589-34-5 |
|---|---|
| SMILES | CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=C(C=C(C(=C2)Br)C)OC |
Product Overview
Ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylate (CAS 873589-34-5), with molecular formula C16H22BrNO5S and molecular weight 419.04 g/mol. IUPAC: ethyl 1-(5-bromo-2-methoxy-4-methylphenyl)sulfonylpiperidine-4-carboxylate.
Chemical Property Profile of Ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylate
Property Insights of Ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylate
The XLogP value of 2.72992 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylate. The TPSA of 72.91 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylate. Following Lipinski's Rule of Five, Ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-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-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylate?
The CAS number of Ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylate is 873589-34-5.
What is the molecular formula of Ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylate?
The molecular formula of Ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylate is C16H22BrNO5S.
What is the molecular weight of Ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylate?
The molecular weight of Ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylate is 419.04 g/mol.
Where can I buy Ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylate?
You can request a quote for Ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-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-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-[(5-bromo-2-methoxy-4-methylphenyl)sulfonyl]-4-piperidinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.