![1-[(3,5-Dimethylphenyl)methyl]piperazine structure](/static/products/5239/523980-91-8.webp)
1-[(3,5-Dimethylphenyl)methyl]piperazine
TL;DR: 1-[(3,5-Dimethylphenyl)methyl]piperazine (CAS 523980-91-8) is a chemical compound with molecular formula C13H20N2 and molecular weight 204.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,5-dimethylphenyl)methyl]piperazine
Also Known As: 1-[(3,5-dimethylphenyl)methyl]piperazine, 1-(3,5-Dimethyl-benzyl)-piperazine, 3-methyl-5-(piperazin-1-ylmethyl)phenol, BB 0249442
| Molecular Formula | C13H20N2 |
|---|---|
| Molecular Weight | 204.16 g/mol |
| LogP | 1.70864 |
| Topological Polar Surface Area | 15.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.16264 |
| Heavy Atoms | 15 |
| Complexity | 307.0579 |
Chemical Identifiers
| CAS Number | 523980-91-8 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)CN2CCNCC2)C |
Product Overview
1-[(3,5-Dimethylphenyl)methyl]piperazine (CAS 523980-91-8), with molecular formula C13H20N2 and molecular weight 204.16 g/mol. IUPAC: 1-[(3,5-dimethylphenyl)methyl]piperazine.
Chemical Property Profile of 1-[(3,5-Dimethylphenyl)methyl]piperazine
Property Insights of 1-[(3,5-Dimethylphenyl)methyl]piperazine
The XLogP value of 1.70864 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(3,5-Dimethylphenyl)methyl]piperazine. With a topological polar surface area (TPSA) of 15.27 Ų, 1-[(3,5-Dimethylphenyl)methyl]piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(3,5-Dimethylphenyl)methyl]piperazine 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 1-[(3,5-Dimethylphenyl)methyl]piperazine?
The CAS number of 1-[(3,5-Dimethylphenyl)methyl]piperazine is 523980-91-8.
What is the molecular formula of 1-[(3,5-Dimethylphenyl)methyl]piperazine?
The molecular formula of 1-[(3,5-Dimethylphenyl)methyl]piperazine is C13H20N2.
What is the molecular weight of 1-[(3,5-Dimethylphenyl)methyl]piperazine?
The molecular weight of 1-[(3,5-Dimethylphenyl)methyl]piperazine is 204.16 g/mol.
Where can I buy 1-[(3,5-Dimethylphenyl)methyl]piperazine?
You can request a quote for 1-[(3,5-Dimethylphenyl)methyl]piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(3,5-Dimethylphenyl)methyl]piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(3,5-Dimethylphenyl)methyl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.