![4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde structure](/static/products/6906/690667-96-0.webp)
4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde
TL;DR: 4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde (CAS 690667-96-0) is a chemical compound with molecular formula C15H19BrN2O3 and molecular weight 354.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(4-bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde
Also Known As: 4-[2-(4-bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde, 4-[(4-bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde
| Molecular Formula | C15H19BrN2O3 |
|---|---|
| Molecular Weight | 354.06 g/mol |
| LogP | 1.74534 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 354.05792 |
| Heavy Atoms | 21 |
| Complexity | 516.7154 |
Chemical Identifiers
| CAS Number | 690667-96-0 |
|---|---|
| SMILES | CC1=CC(=CC(=C1Br)C)OCC(=O)N2CCN(CC2)C=O |
Product Overview
4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde (CAS 690667-96-0), with molecular formula C15H19BrN2O3 and molecular weight 354.06 g/mol. IUPAC: 4-[2-(4-bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde.
Chemical Property Profile of 4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde
Property Insights of 4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde
The XLogP value of 1.74534 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde. With a topological polar surface area (TPSA) of 49.85 Ų, 4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde 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 4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde?
The CAS number of 4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde is 690667-96-0.
What is the molecular formula of 4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde?
The molecular formula of 4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde is C15H19BrN2O3.
What is the molecular weight of 4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde?
The molecular weight of 4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde is 354.06 g/mol.
Where can I buy 4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde?
You can request a quote for 4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-[2-(4-Bromo-3,5-dimethylphenoxy)acetyl]piperazine-1-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.