![4-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde structure](/static/products/439/439691-80-2.png)
4-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde
TL;DR: 4-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde (CAS 439691-80-2) 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-[(4-methylpiperazin-1-yl)methyl]benzaldehyde
Also Known As: 4-[(4-methylpiperazin-1-yl)methyl]benzaldehyde, 1-(4-Formylbenzyl)-4-methylpiperazine, 4-((4-Methylpiperazin-1-yl)methyl)benzaldehyde, 4-[ METHYL]BENZALDEHYDE, Benzaldehyde,4-[(4-methyl-1-piperazinyl)methyl]-
| Molecular Formula | C13H18N2O |
|---|---|
| Molecular Weight | 218.14 g/mol |
| LogP | 1.2465 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.1419 |
| Heavy Atoms | 16 |
| Complexity | 339.45517 |
Chemical Identifiers
| CAS Number | 439691-80-2 |
|---|---|
| SMILES | CN1CCN(CC1)CC2=CC=C(C=C2)C=O |
Product Overview
4-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde (CAS 439691-80-2), with molecular formula C13H18N2O and molecular weight 218.14 g/mol. IUPAC: 4-[(4-methylpiperazin-1-yl)methyl]benzaldehyde.
Chemical Property Profile of 4-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde
Property Insights of 4-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde
The XLogP value of 1.2465 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde. With a topological polar surface area (TPSA) of 23.55 Ų, 4-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde 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-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde?
The CAS number of 4-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde is 439691-80-2.
What is the molecular formula of 4-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde?
The molecular formula of 4-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde is C13H18N2O.
What is the molecular weight of 4-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde?
The molecular weight of 4-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde is 218.14 g/mol.
Where can I buy 4-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde?
You can request a quote for 4-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4-Methylpiperazin-1-yl)methyl]benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.