![2-(4-nitrophenyl)indeno[1,2,3-de]phthalazin-3(2H)-one structure](/static/products/986/98655-83-5.png)
2-(4-nitrophenyl)indeno[1,2,3-de]phthalazin-3(2H)-one
TL;DR: 2-(4-nitrophenyl)indeno[1,2,3-de]phthalazin-3(2H)-one (CAS 98655-83-5) is a chemical compound with molecular formula C20H11N3O3 and molecular weight 341.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-nitrophenyl)-2,3-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-1,5(16),6,8,10,12,14-heptaen-4-one
Also Known As: 2-(4-nitrophenyl)indeno[1,2,3-de]phthalazin-3(2H)-one
| Molecular Formula | C20H11N3O3 |
|---|---|
| Molecular Weight | 341.08 g/mol |
| LogP | 3.9413 |
| Topological Polar Surface Area | 78.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 341.08005 |
| Heavy Atoms | 26 |
| Complexity | 1273.9674 |
Chemical Identifiers
| CAS Number | 98655-83-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=CC=CC4=C3C2=NN(C4=O)C5=CC=C(C=C5)[N+](=O)[O-] |
Product Overview
2-(4-nitrophenyl)indeno[1,2,3-de]phthalazin-3(2H)-one (CAS 98655-83-5), with molecular formula C20H11N3O3 and molecular weight 341.08 g/mol. IUPAC: 3-(4-nitrophenyl)-2,3-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-1,5(16),6,8,10,12,14-heptaen-4-one.
Chemical Property Profile of 2-(4-nitrophenyl)indeno[1,2,3-de]phthalazin-3(2H)-one
Property Insights of 2-(4-nitrophenyl)indeno[1,2,3-de]phthalazin-3(2H)-one
The XLogP value of 3.9413 indicates that 2-(4-nitrophenyl)indeno[1,2,3-de]phthalazin-3(2H)-one 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)indeno[1,2,3-de]phthalazin-3(2H)-one. Following Lipinski's Rule of Five, 2-(4-nitrophenyl)indeno[1,2,3-de]phthalazin-3(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 2-(4-nitrophenyl)indeno[1,2,3-de]phthalazin-3(2H)-one?
The CAS number of 2-(4-nitrophenyl)indeno[1,2,3-de]phthalazin-3(2H)-one is 98655-83-5.
What is the molecular formula of 2-(4-nitrophenyl)indeno[1,2,3-de]phthalazin-3(2H)-one?
The molecular formula of 2-(4-nitrophenyl)indeno[1,2,3-de]phthalazin-3(2H)-one is C20H11N3O3.
What is the molecular weight of 2-(4-nitrophenyl)indeno[1,2,3-de]phthalazin-3(2H)-one?
The molecular weight of 2-(4-nitrophenyl)indeno[1,2,3-de]phthalazin-3(2H)-one is 341.08 g/mol.
Where can I buy 2-(4-nitrophenyl)indeno[1,2,3-de]phthalazin-3(2H)-one?
You can request a quote for 2-(4-nitrophenyl)indeno[1,2,3-de]phthalazin-3(2H)-one 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)indeno[1,2,3-de]phthalazin-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-nitrophenyl)indeno[1,2,3-de]phthalazin-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.