TL;DR: 2-bromo-5-fluoro-N-[(2-methylphenyl)methyl]benzamide (CAS 1271021-08-9) is a chemical compound with molecular formula C15H13BrFNO and molecular weight 321.01645 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-bromo-5-fluoro-N-[(2-methylphenyl)methyl]benzamide
Also Known As: 2-bromo-5-fluoro-N-[(2-methylphenyl)methyl]benzamide
| Molecular Formula | C15H13BrFNO |
| Molecular Weight | 321.01645 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 321.01645 Da |
| Heavy Atoms | 19 |
| Complexity | 313.0 |
| SMILES | CC1=CC=CC=C1CNC(=O)C2=C(C=CC(=C2)F)Br |
| InChIKey | BNCZJSZOZKQJDJ-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that 2-bromo-5-fluoro-N-[(2-methylphenyl)methyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 2-bromo-5-fluoro-N-[(2-methylphenyl)methyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-bromo-5-fluoro-N-[(2-methylphenyl)methyl]benzamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-bromo-5-fluoro-N-[(2-methylphenyl)methyl]benzamide is 1271021-08-9.
The molecular formula of 2-bromo-5-fluoro-N-[(2-methylphenyl)methyl]benzamide is C15H13BrFNO.
The molecular weight of 2-bromo-5-fluoro-N-[(2-methylphenyl)methyl]benzamide is 321.01645 g/mol.
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