TL;DR: N-[(3-bromophenyl)methyl]-2-methoxy-5-methylaniline (CAS 355816-46-5) is a chemical compound with molecular formula C15H16BrNO and molecular weight 305.04153 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(3-bromophenyl)methyl]-2-methoxy-5-methylaniline
Also Known As: BAS 01124708, N-(3-bromobenzyl)-2-methoxy-5-methylaniline, N-[(3-bromophenyl)methyl]-2-methoxy-5-methylaniline, 3-Bromo-N-(2-methoxy-5-methylphenyl)benzenemethanamine, (3-bromobenzyl)(2-methoxy-5-methylphenyl)amine
| Molecular Formula | C15H16BrNO |
| Molecular Weight | 305.04153 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.04153 Da |
| Heavy Atoms | 18 |
| Complexity | 249.0 |
| SMILES | CC1=CC(=C(C=C1)OC)NCC2=CC(=CC=C2)Br |
| InChIKey | HGXDMMUKSIJRRI-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that N-[(3-bromophenyl)methyl]-2-methoxy-5-methylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.3 Ų, N-[(3-bromophenyl)methyl]-2-methoxy-5-methylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(3-bromophenyl)methyl]-2-methoxy-5-methylaniline 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-[(3-bromophenyl)methyl]-2-methoxy-5-methylaniline is 355816-46-5.
The molecular formula of N-[(3-bromophenyl)methyl]-2-methoxy-5-methylaniline is C15H16BrNO.
The molecular weight of N-[(3-bromophenyl)methyl]-2-methoxy-5-methylaniline is 305.04153 g/mol.
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