1-Ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone
TL;DR: 1-Ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone (CAS 957480-19-2) is a chemical compound with molecular formula C18H24N4O and molecular weight 312.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-ethylpyrazol-3-yl)-[4-(2-phenylethyl)piperazin-1-yl]methanone
Also Known As: (1-ethylpyrazol-3-yl)-(4-phenethylpiperazin-1-yl)methanone, 1-ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone, (1-ethylpyrazol-3-yl)-[4-(2-phenylethyl)piperazin-1-yl]methanone, (1-ethyl-1H-pyrazol-3-yl)[4-(2-phenylethyl)piperazin-1-yl]methanone
| Molecular Formula | C18H24N4O |
|---|---|
| Molecular Weight | 312.19 g/mol |
| LogP | 1.9035 |
| Topological Polar Surface Area | 41.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 312.195 |
| Heavy Atoms | 23 |
| Complexity | 629.48096 |
Chemical Identifiers
| CAS Number | 957480-19-2 |
|---|---|
| SMILES | CCN1C=CC(=N1)C(=O)N2CCN(CC2)CCC3=CC=CC=C3 |
Product Overview
1-Ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone (CAS 957480-19-2), with molecular formula C18H24N4O and molecular weight 312.19 g/mol. IUPAC: (1-ethylpyrazol-3-yl)-[4-(2-phenylethyl)piperazin-1-yl]methanone.
Chemical Property Profile of 1-Ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone
Property Insights of 1-Ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone
The XLogP value of 1.9035 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone. With a topological polar surface area (TPSA) of 41.37 Ų, 1-Ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone has 0 hydrogen bond donor(s) and 3 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-Ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone?
The CAS number of 1-Ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone is 957480-19-2.
What is the molecular formula of 1-Ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone?
The molecular formula of 1-Ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone is C18H24N4O.
What is the molecular weight of 1-Ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone?
The molecular weight of 1-Ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone is 312.19 g/mol.
Where can I buy 1-Ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone?
You can request a quote for 1-Ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethylpyrazol-3-yl 4-(2-phenylethyl)piperazinyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.