TL;DR: Piperazine, 1-benzoyl-4-(4-((7-(trifluoromethyl)-4-quinolinyl)amino)benzoyl)- (CAS 130292-75-0) is a chemical compound with molecular formula C28H23F3N4O2 and molecular weight 504.1773 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
phenyl-[4-[4-[[7-(trifluoromethyl)quinolin-4-yl]amino]benzoyl]piperazin-1-yl]methanone
Also Known As: Quinoline deriv., Piperazine, 1-benzoyl-4-(4-((7-(trifluoromethyl)-4-quinolinyl)amino)benzoyl)-, 1-Benzoyl-4-(4-((7-(trifluoromethyl)-4-quinolinyl)amino)benzoylpiperazine, Piperazine,1-benzoyl-4-[4-[[7-(trifluoromethyl)-4-quinolinyl]amino]benzoyl]- (9CI), 1-Benzoyl-4-[4-[[7-(trifluoromethyl)-4-quinolinyl]amino]benzoylpiperazine
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C28H23F3N4O2 |
| Molecular Weight | 504.1773 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 65.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 504.1773 Da |
| Heavy Atoms | 37 |
| Complexity | 787.0 |
| SMILES | C1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)C(F)(F)F |
| InChIKey | BUSKOMZDOWVPEO-UHFFFAOYSA-N |
The XLogP value of 5.0 indicates that Piperazine, 1-benzoyl-4-(4-((7-(trifluoromethyl)-4-quinolinyl)amino)benzoyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Piperazine, 1-benzoyl-4-(4-((7-(trifluoromethyl)-4-quinolinyl)amino)benzoyl)-. Following Lipinski's Rule of Five, Piperazine, 1-benzoyl-4-(4-((7-(trifluoromethyl)-4-quinolinyl)amino)benzoyl)- has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Piperazine, 1-benzoyl-4-(4-((7-(trifluoromethyl)-4-quinolinyl)amino)benzoyl)- is 130292-75-0.
The molecular formula of Piperazine, 1-benzoyl-4-(4-((7-(trifluoromethyl)-4-quinolinyl)amino)benzoyl)- is C28H23F3N4O2.
The molecular weight of Piperazine, 1-benzoyl-4-(4-((7-(trifluoromethyl)-4-quinolinyl)amino)benzoyl)- is 504.1773 g/mol.
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