![1-[(3-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine structure](/static/products/4148/414893-85-9.webp)
1-[(3-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine
TL;DR: 1-[(3-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine (CAS 414893-85-9) is a chemical compound with molecular formula C13H19BrN2O and molecular weight 298.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3-bromo-4-methoxyphenyl)methyl]-4-methylpiperazine
Also Known As: 1-[(3-bromo-4-methoxyphenyl)methyl]-4-methylpiperazine, 1-(3-Bromo-4-methoxybenzyl)-4-methylpiperazine, 1-[(3-bromo-4-methoxy-phenyl)methyl]-4-methyl-piperazine, Q-8199, AB00078473-01
| Molecular Formula | C13H19BrN2O |
|---|---|
| Molecular Weight | 298.07 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 15.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.06808 |
| Heavy Atoms | 17 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 414893-85-9 |
|---|---|
| SMILES | CN1CCN(CC1)CC2=CC(=C(C=C2)OC)Br |
| InChIKey | CKLAWOYBRZEECX-UHFFFAOYSA-N |
Product Overview
1-[(3-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine (CAS 414893-85-9), with molecular formula C13H19BrN2O and molecular weight 298.07 g/mol. IUPAC: 1-[(3-bromo-4-methoxyphenyl)methyl]-4-methylpiperazine.
Chemical Property Profile of 1-[(3-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine
Property Insights of 1-[(3-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(3-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine. With a topological polar surface area (TPSA) of 15.7 Ų, 1-[(3-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(3-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine has 0 hydrogen bond donor(s) and 3 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-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine?
The CAS number of 1-[(3-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine is 414893-85-9.
What is the molecular formula of 1-[(3-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine?
The molecular formula of 1-[(3-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine is C13H19BrN2O.
What is the molecular weight of 1-[(3-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine?
The molecular weight of 1-[(3-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine is 298.07 g/mol.
Where can I buy 1-[(3-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine?
You can request a quote for 1-[(3-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(3-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(3-Bromo-4-methoxyphenyl)methyl]-4-methylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.