TL;DR: (S)-N-Benzylidene-1-methoxy-3-phenylpropan-2-amine (CAS 153827-81-7) is a chemical compound with molecular formula C17H19NO and molecular weight 253.14667 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(2S)-1-methoxy-3-phenylpropan-2-yl]-1-phenylmethanimine
Also Known As: (S)-N-Benzylidene-1-methoxy-3-phenylpropan-2-amine, NCI60_025405, N-[(2S)-1-methoxy-3-phenylpropan-2-yl]-1-phenylmethanimine, (2S)-1-methoxy-3-phenyl-N-[(E)-phenylmethylidene]propan-2-amine
| Molecular Formula | C17H19NO |
| Molecular Weight | 253.14667 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 21.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 253.14667 Da |
| Heavy Atoms | 19 |
| Complexity | 252.0 |
| SMILES | COC[C@H](CC1=CC=CC=C1)N=CC2=CC=CC=C2 |
| InChIKey | SUBNLDMYESIJHW-KRWDZBQOSA-N |
The XLogP value of 3.3 indicates that (S)-N-Benzylidene-1-methoxy-3-phenylpropan-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.6 Ų, (S)-N-Benzylidene-1-methoxy-3-phenylpropan-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-N-Benzylidene-1-methoxy-3-phenylpropan-2-amine has 0 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 (S)-N-Benzylidene-1-methoxy-3-phenylpropan-2-amine is 153827-81-7.
The molecular formula of (S)-N-Benzylidene-1-methoxy-3-phenylpropan-2-amine is C17H19NO.
The molecular weight of (S)-N-Benzylidene-1-methoxy-3-phenylpropan-2-amine is 253.14667 g/mol.
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