TL;DR: 1-(4-Bromophenyl)-2-((4-methoxyphenyl)amino)ethan-1-one (CAS 142739-60-4) is a chemical compound with molecular formula C15H14BrNO2 and molecular weight 319.02078 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-bromophenyl)-2-(4-methoxyanilino)ethanone
Also Known As: 1-(4-bromophenyl)-2-(4-methoxyanilino)ethanone, 1-(4-BROMOPHENYL)-2-((4-METHOXYPHENYL)AMINO)ETHAN-1-ONE, 1-(4-bromophenyl)-2-[(4-methoxyphenyl)amino]ethan-1-one, 1-(4-bromophenyl)-2-[(4-methoxyphenyl)amino]ethanone
| Molecular Formula | C15H14BrNO2 |
| Molecular Weight | 319.02078 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.02078 Da |
| Heavy Atoms | 19 |
| Complexity | 282.0 |
| SMILES | COC1=CC=C(C=C1)NCC(=O)C2=CC=C(C=C2)Br |
| InChIKey | DMQDKFHMRVPIRG-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that 1-(4-Bromophenyl)-2-((4-methoxyphenyl)amino)ethan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, 1-(4-Bromophenyl)-2-((4-methoxyphenyl)amino)ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Bromophenyl)-2-((4-methoxyphenyl)amino)ethan-1-one has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(4-Bromophenyl)-2-((4-methoxyphenyl)amino)ethan-1-one is 142739-60-4.
The molecular formula of 1-(4-Bromophenyl)-2-((4-methoxyphenyl)amino)ethan-1-one is C15H14BrNO2.
The molecular weight of 1-(4-Bromophenyl)-2-((4-methoxyphenyl)amino)ethan-1-one is 319.02078 g/mol.
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