Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride
TL;DR: Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride (CAS 1454-53-1) is a chemical compound with molecular formula C15H20ClNO3 and molecular weight 297.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-benzyl-4-oxopiperidine-3-carboxylate;hydrochloride
Also Known As: Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride, 1-Benzyl-3-carbethoxy-4-piperidone hydrochloride, Ethyl 1-benzyl-4-oxo-3-piperidinecarboxylate hydrochloride, zlchem 240, 1-BENZYL-3-CARBETHOXY-4-PIPERIDONE HCL
| Molecular Formula | C15H20ClNO3 |
|---|---|
| Molecular Weight | 297.11 g/mol |
| LogP | 2.06 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 297.11316 |
| Heavy Atoms | 20 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 1454-53-1 |
|---|---|
| SMILES | CCOC(=O)C1CN(CCC1=O)CC2=CC=CC=C2.Cl |
| InChIKey | YPFMNHZRNXPYBG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride (CAS 1454-53-1), with molecular formula C15H20ClNO3 and molecular weight 297.11 g/mol. IUPAC: ethyl 1-benzyl-4-oxopiperidine-3-carboxylate;hydrochloride.
Chemical Property Profile of Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride
Property Insights of Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride
The XLogP value of 2.06 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride. With a topological polar surface area (TPSA) of 46.6 Ų, Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride has 1 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-benzyl-4-oxopiperidine-3-carboxylate hydrochloride?
The CAS number of Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride is 1454-53-1.
What is the molecular formula of Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride?
The molecular formula of Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride is C15H20ClNO3.
What is the molecular weight of Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride?
The molecular weight of Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride is 297.11 g/mol.
Where can I buy Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride?
You can request a quote for Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.