TL;DR: N-[2-(3-bromo-4-methoxyphenyl)ethyl]benzamide (CAS 159465-28-8) is a chemical compound with molecular formula C16H16BrNO2 and molecular weight 333.03644 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-(3-bromo-4-methoxyphenyl)ethyl]benzamide
Also Known As: N-[2-(3-bromo-4-methoxyphenyl)ethyl]benzamide, N-[2-(3-bromo-4-methoxy-phenyl)ethyl]benzamide
| Molecular Formula | C16H16BrNO2 |
| Molecular Weight | 333.03644 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.03644 Da |
| Heavy Atoms | 20 |
| Complexity | 305.0 |
| SMILES | COC1=C(C=C(C=C1)CCNC(=O)C2=CC=CC=C2)Br |
| InChIKey | NRTARVKKPLFRDM-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that N-[2-(3-bromo-4-methoxyphenyl)ethyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, N-[2-(3-bromo-4-methoxyphenyl)ethyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-(3-bromo-4-methoxyphenyl)ethyl]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 N-[2-(3-bromo-4-methoxyphenyl)ethyl]benzamide is 159465-28-8.
The molecular formula of N-[2-(3-bromo-4-methoxyphenyl)ethyl]benzamide is C16H16BrNO2.
The molecular weight of N-[2-(3-bromo-4-methoxyphenyl)ethyl]benzamide is 333.03644 g/mol.
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