4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone
TL;DR: 4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone (CAS 220998-76-5) is a chemical compound with molecular formula C19H20N4O and molecular weight 320.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-phenylpiperazin-1-yl)methyl]-2H-phthalazin-1-one
Also Known As: 4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone, 4-[(4-phenylpiperazin-1-yl)methyl]-2H-phthalazin-1-one, 5D-015, 4-[(4-phenylpiperazino)methyl]-1(2H)-phthalazinone, 4-[(4-phenylpiperazin-1-yl)methyl]-1,2-dihydrophthalazin-1-one
| Molecular Formula | C19H20N4O |
|---|---|
| Molecular Weight | 320.16 g/mol |
| LogP | 2.2453 |
| Topological Polar Surface Area | 52.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 320.1637 |
| Heavy Atoms | 24 |
| Complexity | 882.5123 |
Chemical Identifiers
| CAS Number | 220998-76-5 |
|---|---|
| SMILES | C1CN(CCN1CC2=NNC(=O)C3=CC=CC=C32)C4=CC=CC=C4 |
Product Overview
4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone (CAS 220998-76-5), with molecular formula C19H20N4O and molecular weight 320.16 g/mol. IUPAC: 4-[(4-phenylpiperazin-1-yl)methyl]-2H-phthalazin-1-one.
Chemical Property Profile of 4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone
Property Insights of 4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone
The XLogP value of 2.2453 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone. With a topological polar surface area (TPSA) of 52.23 Ų, 4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone 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
Frequently Asked Questions
What is the CAS number of 4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone?
The CAS number of 4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone is 220998-76-5.
What is the molecular formula of 4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone?
The molecular formula of 4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone is C19H20N4O.
What is the molecular weight of 4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone?
The molecular weight of 4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone is 320.16 g/mol.
Where can I buy 4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone?
You can request a quote for 4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone?
Yes, KEHONG BIO provides custom synthesis services for 4-((4-Phenylpiperazino)methyl)-1(2H)-phthalazinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.