Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)-
TL;DR: Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)- (CAS 148680-57-3) is a chemical compound with molecular formula C22H22ClFN6O and molecular weight 440.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-5-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-3,3a-dihydropyrazolo[1,5-d][1,2,4]triazin-4-one
Also Known As: Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)-, 2-(4-chlorophenyl)-5-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-3,3a-dihydropyrazolo[1,5-d][1,2,4]triazin-4-one, 2-(4-Chlorophenyl)-5-[4-(4-fluorophenyl)piperazinomethyl]-3,3a-dihydropyrazolo[1,5-d][1,2,4]triazin-4(5H)-one, 2-(4-Chlorophenyl)-5-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-3,3a-dihydropyrazolo[1,5-d][1,2,4]triazin-4(5H)-one, 2-(4-chlorophenyl)-5-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-3H,3aH,4H,5H-pyrazolo[1,5-d][1,2,4]triazin-4-one
| Molecular Formula | C22H22ClFN6O |
|---|---|
| Molecular Weight | 440.15 g/mol |
| LogP | 2.8227 |
| Topological Polar Surface Area | 54.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 440.15277 |
| Heavy Atoms | 31 |
| Complexity | 1017.3016 |
Chemical Identifiers
| CAS Number | 148680-57-3 |
|---|---|
| SMILES | C1CN(CCN1CN2C(=O)C3CC(=NN3C=N2)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)F |
Product Overview
Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)- (CAS 148680-57-3), with molecular formula C22H22ClFN6O and molecular weight 440.15 g/mol. IUPAC: 2-(4-chlorophenyl)-5-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-3,3a-dihydropyrazolo[1,5-d][1,2,4]triazin-4-one.
Chemical Property Profile of Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)-
Property Insights of Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)-
The XLogP value of 2.8227 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)-. With a topological polar surface area (TPSA) of 54.75 Ų, Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)- 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
Frequently Asked Questions
What is the CAS number of Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)-?
The CAS number of Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)- is 148680-57-3.
What is the molecular formula of Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)-?
The molecular formula of Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)- is C22H22ClFN6O.
What is the molecular weight of Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)-?
The molecular weight of Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)- is 440.15 g/mol.
Where can I buy Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)-?
You can request a quote for Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrazolo(1,5-d)(1,2,4)triazin-4(5H)-one, 3,3a-dihydro-2-(4-chlorophenyl)-5-((4-(4-fluorophenyl)-1-piperazinyl)methyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.