TL;DR: 1-Methyl-4-(3-methylphenyl)piperazine (CAS 151657-72-6) is a chemical compound with molecular formula C12H18N2 and molecular weight 190.147 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methyl-4-(3-methylphenyl)piperazine
Also Known As: 1-methyl-4-(3-methylphenyl)piperazine, 1-(3'-methylphenyl)-4-methylpiperazine, Piperazine,1-methyl-4-(3-methylphenyl)-, 1-(3-Methylphenyl)-4-methylpiperazine, Calix[4]arene-4-sulfonic acid sodium salt
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C12H18N2 |
| Molecular Weight | 190.147 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 6.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 190.147 Da |
| Heavy Atoms | 14 |
| Complexity | 173.0 |
| SMILES | CC1=CC(=CC=C1)N2CCN(CC2)C |
| InChIKey | PVFIDFYACCGDBG-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-4-(3-methylphenyl)piperazine. With a topological polar surface area (TPSA) of 6.5 Ų, 1-Methyl-4-(3-methylphenyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-4-(3-methylphenyl)piperazine 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 1-Methyl-4-(3-methylphenyl)piperazine is 151657-72-6.
The molecular formula of 1-Methyl-4-(3-methylphenyl)piperazine is C12H18N2.
The molecular weight of 1-Methyl-4-(3-methylphenyl)piperazine is 190.147 g/mol.
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