TL;DR: 2-(4-Ethylpiperazin-1-yl)-5-(trifluoromethyl)aniline (CAS 1432036-20-8) is a chemical compound with molecular formula C13H18F3N3 and molecular weight 273.1453 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-ethylpiperazin-1-yl)-5-(trifluoromethyl)aniline
Also Known As: 2-(4-ethylpiperazin-1-yl)-5-(trifluoromethyl)aniline, A1-82322, 2-(4-ethylpiperazinyl)-5-(trifluoromethyl)phenylamine, 2-(4-ETHYLPIPERAZINO)-5-(TRIFLUOROMETHYL)ANILINE
| Molecular Formula | C13H18F3N3 |
| Molecular Weight | 273.1453 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 32.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.1453 Da |
| Heavy Atoms | 19 |
| Complexity | 287.0 |
| SMILES | CCN1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)N |
| InChIKey | ANNGGULFZOOOLZ-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Ethylpiperazin-1-yl)-5-(trifluoromethyl)aniline. With a topological polar surface area (TPSA) of 32.5 Ų, 2-(4-Ethylpiperazin-1-yl)-5-(trifluoromethyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Ethylpiperazin-1-yl)-5-(trifluoromethyl)aniline has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(4-Ethylpiperazin-1-yl)-5-(trifluoromethyl)aniline is 1432036-20-8.
The molecular formula of 2-(4-Ethylpiperazin-1-yl)-5-(trifluoromethyl)aniline is C13H18F3N3.
The molecular weight of 2-(4-Ethylpiperazin-1-yl)-5-(trifluoromethyl)aniline is 273.1453 g/mol.
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