2-(4-Methylpiperazin-1-yl)benzaldehyde
TL;DR: 2-(4-Methylpiperazin-1-yl)benzaldehyde (CAS 85803-62-9) is a chemical compound with molecular formula C12H16N2O and molecular weight 204.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylpiperazin-1-yl)benzaldehyde
Also Known As: 2-(4-methylpiperazin-1-yl)benzaldehyde, 2-(4-Methylpiperazino)benzaldehyde, 2-(4-Methylpiperazino)benzadehyde, 4-methylpiperazin-1-ylbenzaldehyde, 2-(4-methylpiperazinyl)benzaldehyde
| Molecular Formula | C12H16N2O |
|---|---|
| Molecular Weight | 204.13 g/mol |
| LogP | 1.2509 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.12627 |
| Heavy Atoms | 15 |
| Complexity | 343.2303 |
Chemical Identifiers
| CAS Number | 85803-62-9 |
|---|---|
| SMILES | CN1CCN(CC1)C2=CC=CC=C2C=O |
Product Overview
2-(4-Methylpiperazin-1-yl)benzaldehyde (CAS 85803-62-9), with molecular formula C12H16N2O and molecular weight 204.13 g/mol. IUPAC: 2-(4-methylpiperazin-1-yl)benzaldehyde.
Chemical Property Profile of 2-(4-Methylpiperazin-1-yl)benzaldehyde
Property Insights of 2-(4-Methylpiperazin-1-yl)benzaldehyde
The XLogP value of 1.2509 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Methylpiperazin-1-yl)benzaldehyde. With a topological polar surface area (TPSA) of 23.55 Ų, 2-(4-Methylpiperazin-1-yl)benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methylpiperazin-1-yl)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 2-(4-Methylpiperazin-1-yl)benzaldehyde?
The CAS number of 2-(4-Methylpiperazin-1-yl)benzaldehyde is 85803-62-9.
What is the molecular formula of 2-(4-Methylpiperazin-1-yl)benzaldehyde?
The molecular formula of 2-(4-Methylpiperazin-1-yl)benzaldehyde is C12H16N2O.
What is the molecular weight of 2-(4-Methylpiperazin-1-yl)benzaldehyde?
The molecular weight of 2-(4-Methylpiperazin-1-yl)benzaldehyde is 204.13 g/mol.
Where can I buy 2-(4-Methylpiperazin-1-yl)benzaldehyde?
You can request a quote for 2-(4-Methylpiperazin-1-yl)benzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methylpiperazin-1-yl)benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methylpiperazin-1-yl)benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.