![4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one structure](/static/products/848/848680-40-0.png)
4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one
TL;DR: 4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one (CAS 848680-40-0) is a chemical compound with molecular formula C27H26N4O2 and molecular weight 438.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(4-benzylpiperazine-1-carbonyl)phenyl]-2-methylphthalazin-1-one
Also Known As: 4-(4-(4-benzylpiperazine-1-carbonyl)phenyl)-2-methylphthalazin-1(2H)-one, 4-[4-(4-benzylpiperazine-1-carbonyl)phenyl]-2-methylphthalazin-1-one, 4-[4-(4-Benzyl-piperazine-1-carbonyl)-phenyl]-2-methyl-2H-phthalazin-1-one, 4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one
| Molecular Formula | C27H26N4O2 |
|---|---|
| Molecular Weight | 438.21 g/mol |
| LogP | 3.5585 |
| Topological Polar Surface Area | 58.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 438.20557 |
| Heavy Atoms | 33 |
| Complexity | 1338.4249 |
Chemical Identifiers
| CAS Number | 848680-40-0 |
|---|---|
| SMILES | CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC=C(C=C3)C(=O)N4CCN(CC4)CC5=CC=CC=C5 |
Product Overview
4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one (CAS 848680-40-0), with molecular formula C27H26N4O2 and molecular weight 438.21 g/mol. IUPAC: 4-[4-(4-benzylpiperazine-1-carbonyl)phenyl]-2-methylphthalazin-1-one.
Chemical Property Profile of 4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one
Property Insights of 4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one
The XLogP value of 3.5585 indicates that 4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.44 Ų, 4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one has 0 hydrogen bond donor(s) and 4 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-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one?
The CAS number of 4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one is 848680-40-0.
What is the molecular formula of 4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one?
The molecular formula of 4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one is C27H26N4O2.
What is the molecular weight of 4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one?
The molecular weight of 4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one is 438.21 g/mol.
Where can I buy 4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one?
You can request a quote for 4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-{4-[(4-benzylpiperazin-1-yl)carbonyl]phenyl}-2-methylphthalazin-1(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.