Ethyl 1-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)piperidine-4-carboxylate
TL;DR: Ethyl 1-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)piperidine-4-carboxylate (CAS 849185-06-4) is a chemical compound with molecular formula C18H21N3O4 and molecular weight 343.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[2-(4-oxo-3H-phthalazin-1-yl)acetyl]piperidine-4-carboxylate
Also Known As: ethyl 1-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)piperidine-4-carboxylate, ethyl 1-[(4-hydroxyphthalazin-1-yl)acetyl]piperidine-4-carboxylate, ethyl 1-[2-(4-oxo-3H-phthalazin-1-yl)acetyl]piperidine-4-carboxylate
| Molecular Formula | C18H21N3O4 |
|---|---|
| Molecular Weight | 343.15 g/mol |
| LogP | 1.2673 |
| Topological Polar Surface Area | 92.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.1532 |
| Heavy Atoms | 25 |
| Complexity | 837.5752 |
Chemical Identifiers
| CAS Number | 849185-06-4 |
|---|---|
| SMILES | CCOC(=O)C1CCN(CC1)C(=O)CC2=NNC(=O)C3=CC=CC=C32 |
Product Overview
Ethyl 1-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)piperidine-4-carboxylate (CAS 849185-06-4), with molecular formula C18H21N3O4 and molecular weight 343.15 g/mol. IUPAC: ethyl 1-[2-(4-oxo-3H-phthalazin-1-yl)acetyl]piperidine-4-carboxylate.
Chemical Property Profile of Ethyl 1-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)piperidine-4-carboxylate
Property Insights of Ethyl 1-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)piperidine-4-carboxylate
The XLogP value of 1.2673 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 1-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)piperidine-4-carboxylate. The TPSA of 92.36 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)piperidine-4-carboxylate. Following Lipinski's Rule of Five, Ethyl 1-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)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-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)piperidine-4-carboxylate?
The CAS number of Ethyl 1-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)piperidine-4-carboxylate is 849185-06-4.
What is the molecular formula of Ethyl 1-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)piperidine-4-carboxylate?
The molecular formula of Ethyl 1-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)piperidine-4-carboxylate is C18H21N3O4.
What is the molecular weight of Ethyl 1-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)piperidine-4-carboxylate?
The molecular weight of Ethyl 1-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)piperidine-4-carboxylate is 343.15 g/mol.
Where can I buy Ethyl 1-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)piperidine-4-carboxylate?
You can request a quote for Ethyl 1-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)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-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)piperidine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-(2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetyl)piperidine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.