Ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate
TL;DR: Ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate (CAS 690984-72-6) is a chemical compound with molecular formula C13H16BrNO4 and molecular weight 329.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate
Also Known As: ethyl 1-(5-bromo-2-furoyl)-4-piperidinecarboxylate, ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate, ethyl 1-[(5-bromofuran-2-yl)carbonyl]piperidine-4-carboxylate
| Molecular Formula | C13H16BrNO4 |
|---|---|
| Molecular Weight | 329.03 g/mol |
| LogP | 2.4574 |
| Topological Polar Surface Area | 59.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.02628 |
| Heavy Atoms | 19 |
| Complexity | 462.9632 |
Chemical Identifiers
| CAS Number | 690984-72-6 |
|---|---|
| SMILES | CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(O2)Br |
Product Overview
Ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate (CAS 690984-72-6), with molecular formula C13H16BrNO4 and molecular weight 329.03 g/mol. IUPAC: ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate.
Chemical Property Profile of Ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate
Property Insights of Ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate
The XLogP value of 2.4574 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate. With a topological polar surface area (TPSA) of 59.75 Ų, Ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-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-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate?
The CAS number of Ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate is 690984-72-6.
What is the molecular formula of Ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate?
The molecular formula of Ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate is C13H16BrNO4.
What is the molecular weight of Ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate?
The molecular weight of Ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate is 329.03 g/mol.
Where can I buy Ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate?
You can request a quote for Ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-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-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-(5-bromofuran-2-carbonyl)piperidine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.