TL;DR: 1,4-Bis[5-(trifluoromethyl)pyridin-2-yl]piperazine (CAS 131136-84-0) is a chemical compound with molecular formula C16H14F6N4 and molecular weight 376.11227 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,4-bis[5-(trifluoromethyl)-2-pyridinyl]piperazine
Also Known As: 1,4-bis[5-(trifluoromethyl)pyridin-2-yl]piperazine, 1,4-BIS(5-(TRIFLUOROMETHYL)-2-PYRIDYL)PIPERAZINE, 1,4-bis[5-(trifluoromethyl)-2-pyridyl]piperazine, 1,4-Bis(5-(trifluoromethyl)pyridin-2-yl)piperazine, AF-399/33192017
| Molecular Formula | C16H14F6N4 |
| Molecular Weight | 376.11227 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 32.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 2 |
| Exact Mass | 376.11227 Da |
| Heavy Atoms | 26 |
| Complexity | 419.0 |
| SMILES | C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C3=NC=C(C=C3)C(F)(F)F |
| InChIKey | NWJPVXBIUDRQLH-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that 1,4-Bis[5-(trifluoromethyl)pyridin-2-yl]piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, 1,4-Bis[5-(trifluoromethyl)pyridin-2-yl]piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Bis[5-(trifluoromethyl)pyridin-2-yl]piperazine has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,4-Bis[5-(trifluoromethyl)pyridin-2-yl]piperazine is 131136-84-0.
The molecular formula of 1,4-Bis[5-(trifluoromethyl)pyridin-2-yl]piperazine is C16H14F6N4.
The molecular weight of 1,4-Bis[5-(trifluoromethyl)pyridin-2-yl]piperazine is 376.11227 g/mol.
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