![4-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium structure](/static/products/5997/5997-74-0.webp)
4-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium
TL;DR: 4-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium (CAS 5997-74-0) is a chemical compound with molecular formula C16H11N3O3 and molecular weight 293.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(4-nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium
Also Known As: NCIOpen2_004182, 4-[2-(4-nitrophenyl)ethenyl]cinnoline 2-oxide, 4-[2-(4-nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium, 4-(2-(4-(Hydroxy(oxido)amino)phenyl)vinyl)-2lambda(5)-cinnolin-2-ol
| Molecular Formula | C16H11N3O3 |
|---|---|
| Molecular Weight | 293.08 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 293.08005 |
| Heavy Atoms | 22 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 5997-74-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C[N+](=N2)[O-])C=CC3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | LYOPOIDBBPJWAO-UHFFFAOYSA-N |
Product Overview
4-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium (CAS 5997-74-0), with molecular formula C16H11N3O3 and molecular weight 293.08 g/mol. IUPAC: 4-[2-(4-nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium.
Chemical Property Profile of 4-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium
Property Insights of 4-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium. Following Lipinski's Rule of Five, 4-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium 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-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium?
The CAS number of 4-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium is 5997-74-0.
What is the molecular formula of 4-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium?
The molecular formula of 4-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium is C16H11N3O3.
What is the molecular weight of 4-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium?
The molecular weight of 4-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium is 293.08 g/mol.
Where can I buy 4-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium?
You can request a quote for 4-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium?
Yes, KEHONG BIO provides custom synthesis services for 4-[2-(4-Nitrophenyl)ethenyl]-2-oxidocinnolin-2-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.