Diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate
TL;DR: Diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate (CAS 94918-93-1) is a chemical compound with molecular formula C21H23N3O5 and molecular weight 397.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 4-oxo-2,6-dipyridin-3-ylpiperidine-3,5-dicarboxylate
Also Known As: BAS 00337678, AE-848/34161059, diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate, BRD-A38784177-001-07-4, diethyl 4-oxo-2,6-di(3-pyridinyl)-3,5-piperidinedicarboxylate
| Molecular Formula | C21H23N3O5 |
|---|---|
| Molecular Weight | 397.16 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 397.16376 |
| Heavy Atoms | 29 |
| Complexity | 551.0 |
Chemical Identifiers
| CAS Number | 94918-93-1 |
|---|---|
| SMILES | CCOC(=O)C1C(NC(C(C1=O)C(=O)OCC)C2=CN=CC=C2)C3=CN=CC=C3 |
| InChIKey | USISSUPZZPBSRF-UHFFFAOYSA-N |
Product Overview
Diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate (CAS 94918-93-1), with molecular formula C21H23N3O5 and molecular weight 397.16 g/mol. IUPAC: diethyl 4-oxo-2,6-dipyridin-3-ylpiperidine-3,5-dicarboxylate.
Chemical Property Profile of Diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate
Property Insights of Diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate. Following Lipinski's Rule of Five, Diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate has 1 hydrogen bond donor(s) and 8 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 Diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate?
The CAS number of Diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate is 94918-93-1.
What is the molecular formula of Diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate?
The molecular formula of Diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate is C21H23N3O5.
What is the molecular weight of Diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate?
The molecular weight of Diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate is 397.16 g/mol.
Where can I buy Diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate?
You can request a quote for Diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 4-oxo-2,6-di(pyridin-3-yl)piperidine-3,5-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.