TL;DR: 2-(4-Methyl-1-piperazinylmethyl)acrylophenone (CAS 91401-12-6) is a chemical compound with molecular formula C15H20N2O and molecular weight 244.15756 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(4-methylpiperazin-1-yl)methyl]-1-phenylprop-2-en-1-one
Also Known As: MPMAP, 2- acrylophenone, Acrylophenone derivitive, 2-(4-Methyl-1-piperazinylmethyl)acrylophenone, N-Methyl-N'-[2-benzoylpropene-3-yl]piperazine
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C15H20N2O |
| Molecular Weight | 244.15756 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 244.15756 Da |
| Heavy Atoms | 18 |
| Complexity | 300.0 |
| SMILES | CN1CCN(CC1)CC(=C)C(=O)C2=CC=CC=C2 |
| InChIKey | UTSBHQHXGFVJMV-UHFFFAOYSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Methyl-1-piperazinylmethyl)acrylophenone. With a topological polar surface area (TPSA) of 23.6 Ų, 2-(4-Methyl-1-piperazinylmethyl)acrylophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methyl-1-piperazinylmethyl)acrylophenone has 0 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 2-(4-Methyl-1-piperazinylmethyl)acrylophenone is 91401-12-6.
The molecular formula of 2-(4-Methyl-1-piperazinylmethyl)acrylophenone is C15H20N2O.
The molecular weight of 2-(4-Methyl-1-piperazinylmethyl)acrylophenone is 244.15756 g/mol.
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