![1-[[4-(4-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole structure](/static/products/3011/301194-20-7.webp)
1-[[4-(4-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole
TL;DR: 1-[[4-(4-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole (CAS 301194-20-7) is a chemical compound with molecular formula C17H18FN5 and molecular weight 311.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]benzotriazole
Also Known As: 1-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]benzotriazole, {[4-(4-fluorophenyl)piperazinyl]methyl}benzotriazole, 1-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1H-1,2,3-benzotriazole, 1-((4-(4-fluorophenyl)piperazino)methyl)-1H-1,2,3-benzotriazole, 1-{[4-(4-fluorophenyl)piperazino]methyl}-1H-1,2,3-benzotriazole
| Molecular Formula | C17H18FN5 |
|---|---|
| Molecular Weight | 311.15 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 37.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 311.15463 |
| Heavy Atoms | 23 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 301194-20-7 |
|---|---|
| SMILES | C1CN(CCN1CN2C3=CC=CC=C3N=N2)C4=CC=C(C=C4)F |
| InChIKey | OHIKBXUXSUVOOZ-UHFFFAOYSA-N |
Product Overview
1-[[4-(4-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole (CAS 301194-20-7), with molecular formula C17H18FN5 and molecular weight 311.15 g/mol. IUPAC: 1-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]benzotriazole.
Chemical Property Profile of 1-[[4-(4-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole
Property Insights of 1-[[4-(4-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole
The XLogP value of 3.0 indicates that 1-[[4-(4-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.2 Ų, 1-[[4-(4-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[[4-(4-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole has 0 hydrogen bond donor(s) and 5 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-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole?
The CAS number of 1-[[4-(4-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole is 301194-20-7.
What is the molecular formula of 1-[[4-(4-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole?
The molecular formula of 1-[[4-(4-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole is C17H18FN5.
What is the molecular weight of 1-[[4-(4-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole?
The molecular weight of 1-[[4-(4-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole is 311.15 g/mol.
Where can I buy 1-[[4-(4-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole?
You can request a quote for 1-[[4-(4-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole 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-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 1-[[4-(4-Fluorophenyl)piperazin-1-yl]methyl]benzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.