![1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one structure](/static/products/4157/415712-72-0.webp)
1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one
TL;DR: 1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one (CAS 415712-72-0) is a chemical compound with molecular formula C18H21N3O and molecular weight 295.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[4-(pyridin-3-ylmethyl)piperazin-1-yl]phenyl]ethanone
Also Known As: 1-(4-{4-[(pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one, 1-[4-[4-(pyridin-3-ylmethyl)piperazin-1-yl]phenyl]ethanone, 1-{4-[4-(3-pyridinylmethyl)-1-piperazinyl]phenyl}ethanone
| Molecular Formula | C18H21N3O |
|---|---|
| Molecular Weight | 295.17 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 36.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.16846 |
| Heavy Atoms | 22 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 415712-72-0 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)N2CCN(CC2)CC3=CN=CC=C3 |
| InChIKey | ZNGSLVXDSMCIAL-UHFFFAOYSA-N |
Product Overview
1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one (CAS 415712-72-0), with molecular formula C18H21N3O and molecular weight 295.17 g/mol. IUPAC: 1-[4-[4-(pyridin-3-ylmethyl)piperazin-1-yl]phenyl]ethanone.
Chemical Property Profile of 1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one
Property Insights of 1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one. With a topological polar surface area (TPSA) of 36.4 Ų, 1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one 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 1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one?
The CAS number of 1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one is 415712-72-0.
What is the molecular formula of 1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one?
The molecular formula of 1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one is C18H21N3O.
What is the molecular weight of 1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one?
The molecular weight of 1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one is 295.17 g/mol.
Where can I buy 1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one?
You can request a quote for 1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-{4-[(Pyridin-3-yl)methyl]piperazin-1-yl}phenyl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.