TL;DR: Piperidine, 4-((4-bromophenyl)phenylmethylene)-1-methyl-, hydrochloride (CAS 130820-47-2) is a chemical compound with molecular formula C19H21BrClN and molecular weight 377.0546 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(4-bromophenyl)-phenylmethylidene]-1-methylpiperidine;hydrochloride
Also Known As: 4-(4-Bromobenzhydrylidene)-1-methylpiperidine hydrochloride, Piperidine, 4-((4-bromophenyl)phenylmethylene)-1-methyl-, hydrochloride, 4-[(4-bromophenyl)(phenyl)methylene]-1-methylpiperidine, 4-[(4-bromophenyl)-phenylmethylidene]-1-methylpiperidine hydrochloride, 4-[(4-Bromophenyl)(phenyl)methylidene]-1-methylpiperidine--hydrogen chloride (1/1)
| Molecular Formula | C19H21BrClN |
| Molecular Weight | 377.0546 g/mol |
| XLogP | 5.3984 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 377.0546 Da |
| Heavy Atoms | 22 |
| Complexity | 352.0 |
| SMILES | CN1CCC(=C(C2=CC=CC=C2)C3=CC=C(C=C3)Br)CC1.Cl |
| InChIKey | AQAUOALBGUGYDN-UHFFFAOYSA-N |
The XLogP value of 5.3984 indicates that Piperidine, 4-((4-bromophenyl)phenylmethylene)-1-methyl-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, Piperidine, 4-((4-bromophenyl)phenylmethylene)-1-methyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperidine, 4-((4-bromophenyl)phenylmethylene)-1-methyl-, hydrochloride has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Piperidine, 4-((4-bromophenyl)phenylmethylene)-1-methyl-, hydrochloride is 130820-47-2.
The molecular formula of Piperidine, 4-((4-bromophenyl)phenylmethylene)-1-methyl-, hydrochloride is C19H21BrClN.
The molecular weight of Piperidine, 4-((4-bromophenyl)phenylmethylene)-1-methyl-, hydrochloride is 377.0546 g/mol.
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