Ethyl 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate
TL;DR: Ethyl 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate (CAS 859672-73-4) is a chemical compound with molecular formula C18H24N2O2 and molecular weight 300.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-(2-pyridin-3-ylpiperidin-1-yl)hex-4-ynoate
Also Known As: ethyl 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate, A4025/0171654, ethyl 6-(2-pyridin-3-ylpiperidin-1-yl)hex-4-ynoate, ETHYL 6-[2-(3-PYRIDYL)PIPERIDINO]-4-HEXYNOATE, ethyl 6-[2-(pyridin-3-yl)piperidin-1-yl]hex-4-ynoate
| Molecular Formula | C18H24N2O2 |
|---|---|
| Molecular Weight | 300.18 g/mol |
| LogP | 2.9553 |
| Topological Polar Surface Area | 42.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 300.18378 |
| Heavy Atoms | 22 |
| Complexity | 518.88385 |
Chemical Identifiers
| CAS Number | 859672-73-4 |
|---|---|
| SMILES | CCOC(=O)CCC#CCN1CCCCC1C2=CN=CC=C2 |
Product Overview
Ethyl 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate (CAS 859672-73-4), with molecular formula C18H24N2O2 and molecular weight 300.18 g/mol. IUPAC: ethyl 6-(2-pyridin-3-ylpiperidin-1-yl)hex-4-ynoate.
Chemical Property Profile of Ethyl 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate
Property Insights of Ethyl 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate
The XLogP value of 2.9553 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate. With a topological polar surface area (TPSA) of 42.43 Ų, Ethyl 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate has 0 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 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate?
The CAS number of Ethyl 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate is 859672-73-4.
What is the molecular formula of Ethyl 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate?
The molecular formula of Ethyl 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate is C18H24N2O2.
What is the molecular weight of Ethyl 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate?
The molecular weight of Ethyl 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate is 300.18 g/mol.
Where can I buy Ethyl 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate?
You can request a quote for Ethyl 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 6-(2-(3-pyridyl)piperidyl)hex-4-ynoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.