2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one
TL;DR: 2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one (CAS 701231-07-4) is a chemical compound with molecular formula C27H26N4O3 and molecular weight 454.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one
Also Known As: 2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one, 2-methyl-4-{4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl}phthalazin-1(2H)-one, 2-methyl-4-(4-(2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy)phenyl)phthalazin-1(2H)-one
| Molecular Formula | C27H26N4O3 |
|---|---|
| Molecular Weight | 454.20 g/mol |
| LogP | 3.3281 |
| Topological Polar Surface Area | 67.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 454.2005 |
| Heavy Atoms | 34 |
| Complexity | 1358.537 |
Chemical Identifiers
| CAS Number | 701231-07-4 |
|---|---|
| SMILES | CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC=C(C=C3)OCC(=O)N4CCN(CC4)C5=CC=CC=C5 |
Product Overview
2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one (CAS 701231-07-4), with molecular formula C27H26N4O3 and molecular weight 454.20 g/mol. IUPAC: 2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one.
Chemical Property Profile of 2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one
Property Insights of 2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one
The XLogP value of 3.3281 indicates that 2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one. Following Lipinski's Rule of Five, 2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one has 0 hydrogen bond donor(s) and 5 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-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one?
The CAS number of 2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one is 701231-07-4.
What is the molecular formula of 2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one?
The molecular formula of 2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one is C27H26N4O3.
What is the molecular weight of 2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one?
The molecular weight of 2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one is 454.20 g/mol.
Where can I buy 2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one?
You can request a quote for 2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-4-[4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethoxy]phenyl]phthalazin-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.