2-(4-(1-(2-(Trifluoromethyl)benzyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate
TL;DR: 2-(4-(1-(2-(Trifluoromethyl)benzyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate (CAS 1048638-11-4) is a chemical compound with molecular formula C21H30F3N3O5 and molecular weight 461.21375 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
oxalic acid;2-[4-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]piperazin-1-yl]ethanol
Also Known As: 2-(4-(1-(2-(trifluoromethyl)benzyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate, IUPAC: Oxalic Acid; 2-[4-[1-[[2-(trifluoromethyl)phenyl]methyl]-4-piperidyl]piperazin-1-yl]ethanol, oxalic acid; 2-[4-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]piperazin-1-yl]ethanol
Technical Specifications
| Molecular Formula | C21H30F3N3O5 |
| Molecular Weight | 461.21375 g/mol |
| XLogP | 1.4353 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 461.21375 Da |
| Heavy Atoms | 32 |
| Complexity | 490.0 |
| SMILES | C1CN(CCC1N2CCN(CC2)CCO)CC3=CC=CC=C3C(F)(F)F.C(=O)(C(=O)O)O |
| InChIKey | UYAZFSYWQSFHLQ-UHFFFAOYSA-N |
Chemical Property Profile of 2-(4-(1-(2-(Trifluoromethyl)benzyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate
Property Insights of 2-(4-(1-(2-(Trifluoromethyl)benzyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate
The XLogP value of 1.4353 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-(1-(2-(Trifluoromethyl)benzyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-(1-(2-(Trifluoromethyl)benzyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate. Following Lipinski's Rule of Five, 2-(4-(1-(2-(Trifluoromethyl)benzyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate has 3 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2-(4-(1-(2-(Trifluoromethyl)benzyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate?
The CAS number of 2-(4-(1-(2-(Trifluoromethyl)benzyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate is 1048638-11-4.
What is the molecular formula of 2-(4-(1-(2-(Trifluoromethyl)benzyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate?
The molecular formula of 2-(4-(1-(2-(Trifluoromethyl)benzyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate is C21H30F3N3O5.
What is the molecular weight of 2-(4-(1-(2-(Trifluoromethyl)benzyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate?
The molecular weight of 2-(4-(1-(2-(Trifluoromethyl)benzyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate is 461.21375 g/mol.
Where can I buy 2-(4-(1-(2-(Trifluoromethyl)benzyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate?
You can request a quote for 2-(4-(1-(2-(Trifluoromethyl)benzyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4-(1-(2-(Trifluoromethyl)benzyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate?
Yes, CoreyChem provides custom synthesis services for 2-(4-(1-(2-(Trifluoromethyl)benzyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.