2-(4-Nitrophenyl)-4-phenyl-1(2H)-phthalazinone
TL;DR: 2-(4-Nitrophenyl)-4-phenyl-1(2H)-phthalazinone (CAS 57709-78-1) is a chemical compound with molecular formula C20H13N3O3 and molecular weight 343.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-nitrophenyl)-4-phenylphthalazin-1-one
Also Known As: BAS 00659594, 2-(4-nitrophenyl)-4-phenylphthalazin-1-one, 2-(4-Nitrophenyl)-4-phenyl-1(2H)-phthalazinone, 2-(4-Nitrophenyl)-4-phenylphthalazin-1(2H)-one, 2-(4-Nitro-phenyl)-4-phenyl-2H-phthalazin-1-one
| Molecular Formula | C20H13N3O3 |
|---|---|
| Molecular Weight | 343.10 g/mol |
| LogP | 3.9609 |
| Topological Polar Surface Area | 78.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 343.0957 |
| Heavy Atoms | 26 |
| Complexity | 1166.5189 |
Chemical Identifiers
| CAS Number | 57709-78-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
2-(4-Nitrophenyl)-4-phenyl-1(2H)-phthalazinone (CAS 57709-78-1), with molecular formula C20H13N3O3 and molecular weight 343.10 g/mol. IUPAC: 2-(4-nitrophenyl)-4-phenylphthalazin-1-one.
Chemical Property Profile of 2-(4-Nitrophenyl)-4-phenyl-1(2H)-phthalazinone
Property Insights of 2-(4-Nitrophenyl)-4-phenyl-1(2H)-phthalazinone
The XLogP value of 3.9609 indicates that 2-(4-Nitrophenyl)-4-phenyl-1(2H)-phthalazinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Nitrophenyl)-4-phenyl-1(2H)-phthalazinone. Following Lipinski's Rule of Five, 2-(4-Nitrophenyl)-4-phenyl-1(2H)-phthalazinone 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 2-(4-Nitrophenyl)-4-phenyl-1(2H)-phthalazinone?
The CAS number of 2-(4-Nitrophenyl)-4-phenyl-1(2H)-phthalazinone is 57709-78-1.
What is the molecular formula of 2-(4-Nitrophenyl)-4-phenyl-1(2H)-phthalazinone?
The molecular formula of 2-(4-Nitrophenyl)-4-phenyl-1(2H)-phthalazinone is C20H13N3O3.
What is the molecular weight of 2-(4-Nitrophenyl)-4-phenyl-1(2H)-phthalazinone?
The molecular weight of 2-(4-Nitrophenyl)-4-phenyl-1(2H)-phthalazinone is 343.10 g/mol.
Where can I buy 2-(4-Nitrophenyl)-4-phenyl-1(2H)-phthalazinone?
You can request a quote for 2-(4-Nitrophenyl)-4-phenyl-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 2-(4-Nitrophenyl)-4-phenyl-1(2H)-phthalazinone?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Nitrophenyl)-4-phenyl-1(2H)-phthalazinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.