TL;DR: 3-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)piperazin-2-one (CAS 1007919-73-4) is a chemical compound with molecular formula C15H18N4O and molecular weight 270.14807 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3,5-dimethyl-1-phenylpyrazol-4-yl)piperazin-2-one
Also Known As: 3-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)piperazin-2-one, 3-(3,5-dimethyl-1-phenylpyrazol-4-yl)piperazin-2-one, 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one
| Molecular Formula | C15H18N4O |
| Molecular Weight | 270.14807 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 59.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 270.14807 Da |
| Heavy Atoms | 20 |
| Complexity | 356.0 |
| SMILES | CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3 |
| InChIKey | VJMTUHWRCZDCDW-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)piperazin-2-one. With a topological polar surface area (TPSA) of 59.0 Ų, 3-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)piperazin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)piperazin-2-one has 2 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 3-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)piperazin-2-one is 1007919-73-4.
The molecular formula of 3-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)piperazin-2-one is C15H18N4O.
The molecular weight of 3-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)piperazin-2-one is 270.14807 g/mol.
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