4-(2-Hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one
TL;DR: 4-(2-Hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one (CAS 104688-41-7) is a chemical compound with molecular formula C22H28N2O3 and molecular weight 368.21 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2-hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one
Also Known As: 1-(4-(2-Hydroxy-5-methoxyphenyl)-1-oxo-4-phenylbutyl)-4-methylpiperazine, 4-(2-hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one, 4-(2-Hydroxy-5-methoxyphenyl)-4-phenylbutyric acid, N-methylpiperazinyl amide, Piperazine, 1-(4-(2-hydroxy-5-methoxyphenyl)-1-oxo-4-phenylbutyl)-4-methyl-, 1-[4-(2-Hydroxy-5-methoxyphenyl)-4-phenylbutyryl]-4-methylpiperazine
Technical Specifications
| Molecular Formula | C22H28N2O3 |
| Molecular Weight | 368.21 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 53.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 368.21 Da |
| Heavy Atoms | 27 |
| Complexity | 458.0 |
| SMILES | CN1CCN(CC1)C(=O)CCC(C2=CC=CC=C2)C3=C(C=CC(=C3)OC)O |
| InChIKey | WBGKSOGUMQKYCN-UHFFFAOYSA-N |
Chemical Property Profile of 4-(2-Hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one
Property Insights of 4-(2-Hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one. With a topological polar surface area (TPSA) of 53.0 Ų, 4-(2-Hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-Hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one 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 4-(2-Hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one?
The CAS number of 4-(2-Hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one is 104688-41-7.
What is the molecular formula of 4-(2-Hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one?
The molecular formula of 4-(2-Hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one is C22H28N2O3.
What is the molecular weight of 4-(2-Hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one?
The molecular weight of 4-(2-Hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one is 368.21 g/mol.
Where can I buy 4-(2-Hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one?
You can request a quote for 4-(2-Hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(2-Hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one?
Yes, CoreyChem provides custom synthesis services for 4-(2-Hydroxy-5-methoxyphenyl)-1-(4-methylpiperazin-1-yl)-4-phenylbutan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.