ethyl 1-(6-bromo-2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate
TL;DR: ethyl 1-(6-bromo-2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate (CAS 695218-50-9) is a chemical compound with molecular formula C18H18BrNO5 and molecular weight 407.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-(6-bromo-2-oxochromene-3-carbonyl)piperidine-4-carboxylate
Also Known As: VU0324069-2, AB00611463-02, AB00611463-07, ethyl 1-(6-bromo-2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate, F3127-0356
| Molecular Formula | C18H18BrNO5 |
|---|---|
| Molecular Weight | 407.04 g/mol |
| LogP | 2.9708 |
| Topological Polar Surface Area | 76.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 407.03683 |
| Heavy Atoms | 25 |
| Complexity | 867.38574 |
Chemical Identifiers
| CAS Number | 695218-50-9 |
|---|---|
| SMILES | CCOC(=O)C1CCN(CC1)C(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O |
Product Overview
ethyl 1-(6-bromo-2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate (CAS 695218-50-9), with molecular formula C18H18BrNO5 and molecular weight 407.04 g/mol. IUPAC: ethyl 1-(6-bromo-2-oxochromene-3-carbonyl)piperidine-4-carboxylate.
Chemical Property Profile of ethyl 1-(6-bromo-2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate
Property Insights of ethyl 1-(6-bromo-2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate
The XLogP value of 2.9708 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 1-(6-bromo-2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate. The TPSA of 76.82 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 1-(6-bromo-2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate. Following Lipinski's Rule of Five, ethyl 1-(6-bromo-2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate 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-(6-bromo-2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate?
The CAS number of ethyl 1-(6-bromo-2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate is 695218-50-9.
What is the molecular formula of ethyl 1-(6-bromo-2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate?
The molecular formula of ethyl 1-(6-bromo-2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate is C18H18BrNO5.
What is the molecular weight of ethyl 1-(6-bromo-2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate?
The molecular weight of ethyl 1-(6-bromo-2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate is 407.04 g/mol.
Where can I buy ethyl 1-(6-bromo-2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate?
You can request a quote for ethyl 1-(6-bromo-2-oxo-2H-chromene-3-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-(6-bromo-2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 1-(6-bromo-2-oxo-2H-chromene-3-carbonyl)piperidine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.