5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-one
TL;DR: 5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-one (CAS 315682-88-3) is a chemical compound with molecular formula C21H21N5O and molecular weight 359.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-ethylpiperazin-1-yl)quinazolino[2,3-a]phthalazin-8-one
Also Known As: AF-399/15128467, 10-(4-ethylpiperazin-1-yl)-13H-5,11,12-triazatetraphen-13-one, 5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-one, F0863-0229, 5-(4-ethyl-1-piperazinyl)-8H-phthalazino[1,2-b]quinazolin-8-one
| Molecular Formula | C21H21N5O |
|---|---|
| Molecular Weight | 359.17 g/mol |
| LogP | 2.5378 |
| Topological Polar Surface Area | 53.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 359.17462 |
| Heavy Atoms | 27 |
| Complexity | 1207.7781 |
Chemical Identifiers
| CAS Number | 315682-88-3 |
|---|---|
| SMILES | CCN1CCN(CC1)C2=NN3C(=NC4=CC=CC=C4C3=O)C5=CC=CC=C52 |
Product Overview
5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-one (CAS 315682-88-3), with molecular formula C21H21N5O and molecular weight 359.17 g/mol. IUPAC: 5-(4-ethylpiperazin-1-yl)quinazolino[2,3-a]phthalazin-8-one.
Chemical Property Profile of 5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-one
Property Insights of 5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-one
The XLogP value of 2.5378 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-one. With a topological polar surface area (TPSA) of 53.74 Ų, 5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-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 5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-one?
The CAS number of 5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-one is 315682-88-3.
What is the molecular formula of 5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-one?
The molecular formula of 5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-one is C21H21N5O.
What is the molecular weight of 5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-one?
The molecular weight of 5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-one is 359.17 g/mol.
Where can I buy 5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-one?
You can request a quote for 5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-ethylpiperazin-1-yl)-8H-phthalazino[1,2-b]quinazolin-8-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.