![4-[(3,5-Dimethylphenyl)methyl]piperazin-2-one structure](/static/products/923/923690-82-8.png)
4-[(3,5-Dimethylphenyl)methyl]piperazin-2-one
TL;DR: 4-[(3,5-Dimethylphenyl)methyl]piperazin-2-one (CAS 923690-82-8) is a chemical compound with molecular formula C13H18N2O and molecular weight 218.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3,5-dimethylphenyl)methyl]piperazin-2-one
Also Known As: 4-(3,5-Dimethylbenzyl)piperazin-2-one, 4-[(3,5-dimethylphenyl)methyl]piperazin-2-one, 4-(3,5-dimethylbenzyl)-2-piperazinone
| Molecular Formula | C13H18N2O |
|---|---|
| Molecular Weight | 218.14 g/mol |
| LogP | 1.23524 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.1419 |
| Heavy Atoms | 16 |
| Complexity | 380.6691 |
Chemical Identifiers
| CAS Number | 923690-82-8 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)CN2CCNC(=O)C2)C |
Product Overview
4-[(3,5-Dimethylphenyl)methyl]piperazin-2-one (CAS 923690-82-8), with molecular formula C13H18N2O and molecular weight 218.14 g/mol. IUPAC: 4-[(3,5-dimethylphenyl)methyl]piperazin-2-one.
Chemical Property Profile of 4-[(3,5-Dimethylphenyl)methyl]piperazin-2-one
Property Insights of 4-[(3,5-Dimethylphenyl)methyl]piperazin-2-one
The XLogP value of 1.23524 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(3,5-Dimethylphenyl)methyl]piperazin-2-one. With a topological polar surface area (TPSA) of 32.34 Ų, 4-[(3,5-Dimethylphenyl)methyl]piperazin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(3,5-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
Frequently Asked Questions
What is the CAS number of 4-[(3,5-Dimethylphenyl)methyl]piperazin-2-one?
The CAS number of 4-[(3,5-Dimethylphenyl)methyl]piperazin-2-one is 923690-82-8.
What is the molecular formula of 4-[(3,5-Dimethylphenyl)methyl]piperazin-2-one?
The molecular formula of 4-[(3,5-Dimethylphenyl)methyl]piperazin-2-one is C13H18N2O.
What is the molecular weight of 4-[(3,5-Dimethylphenyl)methyl]piperazin-2-one?
The molecular weight of 4-[(3,5-Dimethylphenyl)methyl]piperazin-2-one is 218.14 g/mol.
Where can I buy 4-[(3,5-Dimethylphenyl)methyl]piperazin-2-one?
You can request a quote for 4-[(3,5-Dimethylphenyl)methyl]piperazin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(3,5-Dimethylphenyl)methyl]piperazin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3,5-Dimethylphenyl)methyl]piperazin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.