ethyl 1-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)piperidine-4-carboxylate
TL;DR: ethyl 1-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)piperidine-4-carboxylate (CAS 296790-64-2) is a chemical compound with molecular formula C13H19N3O4 and molecular weight 281.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[(3,6-dioxo-1H-pyridazin-2-yl)methyl]piperidine-4-carboxylate
Also Known As: BAS 03147590, A1751/0074301, ethyl 1-[(3,6-dioxo-1H-pyridazin-2-yl)methyl]piperidine-4-carboxylate, ethyl 1-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)piperidine-4-carboxylate, ETHYL 1-[(3-HYDROXY-6-OXO-1,6-DIHYDROPYRIDAZIN-1-YL)METHYL]PIPERIDINE-4-CARBOXYLATE
| Molecular Formula | C13H19N3O4 |
|---|---|
| Molecular Weight | 281.14 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 79.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 281.13754 |
| Heavy Atoms | 20 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 296790-64-2 |
|---|---|
| SMILES | CCOC(=O)C1CCN(CC1)CN2C(=O)C=CC(=O)N2 |
| InChIKey | JGRMNQAAQQRGEK-UHFFFAOYSA-N |
Product Overview
ethyl 1-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)piperidine-4-carboxylate (CAS 296790-64-2), with molecular formula C13H19N3O4 and molecular weight 281.14 g/mol. IUPAC: ethyl 1-[(3,6-dioxo-1H-pyridazin-2-yl)methyl]piperidine-4-carboxylate.
Chemical Property Profile of ethyl 1-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)piperidine-4-carboxylate
Property Insights of ethyl 1-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)piperidine-4-carboxylate
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 1-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)piperidine-4-carboxylate. The TPSA of 79.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 1-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)piperidine-4-carboxylate. Following Lipinski's Rule of Five, ethyl 1-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)piperidine-4-carboxylate has 1 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-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)piperidine-4-carboxylate?
The CAS number of ethyl 1-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)piperidine-4-carboxylate is 296790-64-2.
What is the molecular formula of ethyl 1-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)piperidine-4-carboxylate?
The molecular formula of ethyl 1-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)piperidine-4-carboxylate is C13H19N3O4.
What is the molecular weight of ethyl 1-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)piperidine-4-carboxylate?
The molecular weight of ethyl 1-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)piperidine-4-carboxylate is 281.14 g/mol.
Where can I buy ethyl 1-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)piperidine-4-carboxylate?
You can request a quote for ethyl 1-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)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-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)piperidine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 1-((3-hydroxy-6-oxopyridazin-1(6H)-yl)methyl)piperidine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.