![5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine structure](/static/products/865/865658-83-9.png)
5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine
TL;DR: 5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine (CAS 865658-83-9) is a chemical compound with molecular formula C17H17FN4 and molecular weight 296.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[3-[4-(4-fluorophenyl)piperazin-1-yl]prop-1-ynyl]pyrimidine
Also Known As: 5-{3-[4-(4-fluorophenyl)piperazino]-1-propynyl}pyrimidine, 5-{3-[4-(4-fluorophenyl)piperazin-1-yl]prop-1-yn-1-yl}pyrimidine, 5-[3-[4-(4-fluorophenyl)piperazin-1-yl]prop-1-ynyl]pyrimidine, 3W-0824, 5-{3-4-(4-Fluorophenyl)piperazino-1-propynyl}pyrimidine
| Molecular Formula | C17H17FN4 |
|---|---|
| Molecular Weight | 296.14 g/mol |
| LogP | 1.7894 |
| Topological Polar Surface Area | 32.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.14374 |
| Heavy Atoms | 22 |
| Complexity | 652.55347 |
Chemical Identifiers
| CAS Number | 865658-83-9 |
|---|---|
| SMILES | C1CN(CCN1CC#CC2=CN=CN=C2)C3=CC=C(C=C3)F |
Product Overview
5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine (CAS 865658-83-9), with molecular formula C17H17FN4 and molecular weight 296.14 g/mol. IUPAC: 5-[3-[4-(4-fluorophenyl)piperazin-1-yl]prop-1-ynyl]pyrimidine.
Chemical Property Profile of 5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine
Property Insights of 5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine
The XLogP value of 1.7894 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine. With a topological polar surface area (TPSA) of 32.26 Ų, 5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine 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 5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine?
The CAS number of 5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine is 865658-83-9.
What is the molecular formula of 5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine?
The molecular formula of 5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine is C17H17FN4.
What is the molecular weight of 5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine?
The molecular weight of 5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine is 296.14 g/mol.
Where can I buy 5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine?
You can request a quote for 5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 5-{3-[4-(4-Fluorophenyl)piperazino]-1-propynyl}pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.