![4-[(2,5-Dimethylphenyl)methyl]piperazin-2-one structure](/static/products/114/1147448-66-5.webp)
4-[(2,5-Dimethylphenyl)methyl]piperazin-2-one
TL;DR: 4-[(2,5-Dimethylphenyl)methyl]piperazin-2-one (CAS 1147448-66-5) is a chemical compound with molecular formula C13H18N2O and molecular weight 218.1419 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(2,5-dimethylphenyl)methyl]piperazin-2-one
Also Known As: 4-[(2,5-dimethylphenyl)methyl]piperazin-2-one, AB00996074-01
Technical Specifications
| Molecular Formula | C13H18N2O |
| Molecular Weight | 218.1419 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.1419 Da |
| Heavy Atoms | 16 |
| Complexity | 254.0 |
| SMILES | CC1=CC(=C(C=C1)C)CN2CCNC(=O)C2 |
| InChIKey | SBVXNDFOTQWJHF-UHFFFAOYSA-N |
Chemical Property Profile of 4-[(2,5-Dimethylphenyl)methyl]piperazin-2-one
Property Insights of 4-[(2,5-Dimethylphenyl)methyl]piperazin-2-one
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(2,5-Dimethylphenyl)methyl]piperazin-2-one. With a topological polar surface area (TPSA) of 32.3 Ų, 4-[(2,5-Dimethylphenyl)methyl]piperazin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(2,5-Dimethylphenyl)methyl]piperazin-2-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-[(2,5-Dimethylphenyl)methyl]piperazin-2-one?
The CAS number of 4-[(2,5-Dimethylphenyl)methyl]piperazin-2-one is 1147448-66-5.
What is the molecular formula of 4-[(2,5-Dimethylphenyl)methyl]piperazin-2-one?
The molecular formula of 4-[(2,5-Dimethylphenyl)methyl]piperazin-2-one is C13H18N2O.
What is the molecular weight of 4-[(2,5-Dimethylphenyl)methyl]piperazin-2-one?
The molecular weight of 4-[(2,5-Dimethylphenyl)methyl]piperazin-2-one is 218.1419 g/mol.
Where can I buy 4-[(2,5-Dimethylphenyl)methyl]piperazin-2-one?
You can request a quote for 4-[(2,5-Dimethylphenyl)methyl]piperazin-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-[(2,5-Dimethylphenyl)methyl]piperazin-2-one?
Yes, CoreyChem provides custom synthesis services for 4-[(2,5-Dimethylphenyl)methyl]piperazin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.