TL;DR: Pyrazole, 1-benzyl-3-methyl-5-(2-(1-piperazinyl)ethoxy)- (CAS 15090-11-6) is a chemical compound with molecular formula C17H24N4O and molecular weight 300.195 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-(2-benzyl-5-methylpyrazol-3-yl)oxyethyl]piperazine
Also Known As: B-323, Pyrazole, 1-benzyl-3-methyl-5-(2-(1-piperazinyl)ethoxy)-, 1-Benzyl-3-methyl-5-(2-(1-piperazinyl)ethoxy)pyrazole, 5-23-10-00534 (Beilstein Handbook Reference), 1-{2-[(1-benzyl-3-methyl-1H-pyrazol-5-yl)oxy]ethyl}piperazine
| Molecular Formula | C17H24N4O |
| Molecular Weight | 300.195 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 42.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 300.195 Da |
| Heavy Atoms | 22 |
| Complexity | 316.0 |
| SMILES | CC1=NN(C(=C1)OCCN2CCNCC2)CC3=CC=CC=C3 |
| InChIKey | IZXQOIJROMIKGK-UHFFFAOYSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrazole, 1-benzyl-3-methyl-5-(2-(1-piperazinyl)ethoxy)-. With a topological polar surface area (TPSA) of 42.3 Ų, Pyrazole, 1-benzyl-3-methyl-5-(2-(1-piperazinyl)ethoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrazole, 1-benzyl-3-methyl-5-(2-(1-piperazinyl)ethoxy)- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Pyrazole, 1-benzyl-3-methyl-5-(2-(1-piperazinyl)ethoxy)- is 15090-11-6.
The molecular formula of Pyrazole, 1-benzyl-3-methyl-5-(2-(1-piperazinyl)ethoxy)- is C17H24N4O.
The molecular weight of Pyrazole, 1-benzyl-3-methyl-5-(2-(1-piperazinyl)ethoxy)- is 300.195 g/mol.
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