n-Pentasilane
TL;DR: n-Pentasilane (CAS 148680-62-0) is a chemical compound with molecular formula C22H21FN6O and molecular weight 404.1761 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-2-phenylpyrazolo[1,5-d][1,2,4]triazin-4-one
Also Known As: n-Pentasilane, Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)-2-phenyl-, 5-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-2-phenylpyrazolo[1,5-d][1,2,4]triazin-4-one, 4-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-8-phenyl-1,3,4,9-tetrazab icyclo[4.3.0]nona-2,6,8-trien, 2-Phenyl-5-[4-(4-fluorophenyl)piperazinomethyl]pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
Technical Specifications
| Molecular Formula | C22H21FN6O |
| Molecular Weight | 404.1761 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 57.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 404.1761 Da |
| Heavy Atoms | 30 |
| Complexity | 625.0 |
| SMILES | C1CN(CCN1CN2C(=O)C3=CC(=NN3C=N2)C4=CC=CC=C4)C5=CC=C(C=C5)F |
| InChIKey | SOUIHMOJVCWUSE-UHFFFAOYSA-N |
Chemical Property Profile of n-Pentasilane
Property Insights of n-Pentasilane
The XLogP value of 3.5 indicates that n-Pentasilane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.0 Ų, n-Pentasilane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-Pentasilane has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of n-Pentasilane?
The CAS number of n-Pentasilane is 148680-62-0.
What is the molecular formula of n-Pentasilane?
The molecular formula of n-Pentasilane is C22H21FN6O.
What is the molecular weight of n-Pentasilane?
The molecular weight of n-Pentasilane is 404.1761 g/mol.
Where can I buy n-Pentasilane?
You can request a quote for n-Pentasilane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for n-Pentasilane?
Yes, CoreyChem provides custom synthesis services for n-Pentasilane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.