TL;DR: N-[[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]methyl]-1-(oxolan-2-yl)methanamine (CAS 893613-32-6) is a chemical compound with molecular formula C19H21BrClNO2 and molecular weight 409.04443 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]methyl]-1-(oxolan-2-yl)methanamine
Also Known As: N-[[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]methyl]-1-(oxolan-2-yl)methanamine, N-[[5-Bromo-2-[(2-chlorophenyl)methoxy]phenyl]methyl]tetrahydro-2-furanmethanamine, 1-{5-Bromo-2-[(2-chlorophenyl)methoxy]phenyl}-N-[(oxolan-2-yl)methyl]methanamine
| Molecular Formula | C19H21BrClNO2 |
| Molecular Weight | 409.04443 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 30.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 409.04443 Da |
| Heavy Atoms | 24 |
| Complexity | 373.0 |
| SMILES | C1CC(OC1)CNCC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3Cl |
| InChIKey | CTMVKODOQQDHQS-UHFFFAOYSA-N |
The XLogP value of 4.5 indicates that N-[[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]methyl]-1-(oxolan-2-yl)methanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.5 Ų, N-[[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]methyl]-1-(oxolan-2-yl)methanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]methyl]-1-(oxolan-2-yl)methanamine 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 N-[[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]methyl]-1-(oxolan-2-yl)methanamine is 893613-32-6.
The molecular formula of N-[[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]methyl]-1-(oxolan-2-yl)methanamine is C19H21BrClNO2.
The molecular weight of N-[[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]methyl]-1-(oxolan-2-yl)methanamine is 409.04443 g/mol.
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