![3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol structure](/static/products/152/152451-77-9.webp)
3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol
TL;DR: 3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol (CAS 152451-77-9) is a chemical compound with molecular formula C12H17N3O and molecular weight 219.13716 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(E)-(4-methylpiperazin-1-yl)iminomethyl]phenol
Also Known As: 3-[(4-methylpiperazin-1-yl)iminomethyl]phenol, 3-[(E)-(4-methylpiperazin-1-yl)iminomethyl]phenol, 3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol
Technical Specifications
| Molecular Formula | C12H17N3O |
| Molecular Weight | 219.13716 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 39.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 219.13716 Da |
| Heavy Atoms | 16 |
| Complexity | 236.0 |
| SMILES | CN1CCN(CC1)/N=C/C2=CC(=CC=C2)O |
| InChIKey | JYJNBTFKIADKLK-JLHYYAGUSA-N |
Chemical Property Profile of 3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol
Property Insights of 3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol. With a topological polar surface area (TPSA) of 39.1 Ų, 3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol?
The CAS number of 3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol is 152451-77-9.
What is the molecular formula of 3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol?
The molecular formula of 3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol is C12H17N3O.
What is the molecular weight of 3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol?
The molecular weight of 3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol is 219.13716 g/mol.
Where can I buy 3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol?
You can request a quote for 3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol?
Yes, CoreyChem provides custom synthesis services for 3-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.