TL;DR: Benzamide, 4-bromo-N-[4-fluoro-3-(trifluoromethyl)phenyl]- (CAS 56661-29-1) is a chemical compound with molecular formula C14H8BrF4NO and molecular weight 360.97253 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-bromo-N-[4-fluoro-3-(trifluoromethyl)phenyl]benzamide
Also Known As: 4-bromo-N-[4-fluoro-3-(trifluoromethyl)phenyl]benzamide, Benzamide, 4-bromo-N-[4-fluoro-3-(trifluoromethyl)phenyl]-, 4-<4-(4-chlorophenyl)-4-hydroxypiperidino>-1,1-ethylenedioxy-1-(4-fluorophenyl)butane
| Molecular Formula | C14H8BrF4NO |
| Molecular Weight | 360.97253 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 360.97253 Da |
| Heavy Atoms | 21 |
| Complexity | 368.0 |
| SMILES | C1=CC(=CC=C1C(=O)NC2=CC(=C(C=C2)F)C(F)(F)F)Br |
| InChIKey | NIQPMPHUGKTQRB-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that Benzamide, 4-bromo-N-[4-fluoro-3-(trifluoromethyl)phenyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, Benzamide, 4-bromo-N-[4-fluoro-3-(trifluoromethyl)phenyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzamide, 4-bromo-N-[4-fluoro-3-(trifluoromethyl)phenyl]- has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Benzamide, 4-bromo-N-[4-fluoro-3-(trifluoromethyl)phenyl]- is 56661-29-1.
The molecular formula of Benzamide, 4-bromo-N-[4-fluoro-3-(trifluoromethyl)phenyl]- is C14H8BrF4NO.
The molecular weight of Benzamide, 4-bromo-N-[4-fluoro-3-(trifluoromethyl)phenyl]- is 360.97253 g/mol.
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