6-[5-(2-Fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone
TL;DR: 6-[5-(2-Fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone (CAS 384351-73-9) is a chemical compound with molecular formula C15H12FN3O3 and molecular weight 301.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-4-nitrophenol
Also Known As: 2-[5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-4-nitrophenol, 6-[5-(2-fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone, 2-(5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-3-yl)-4-nitrophenol, F3139-0361, 2-[5-(2-fluorophenyl)(2-pyrazolin-3-yl)]-4-nitrophenol
| Molecular Formula | C15H12FN3O3 |
|---|---|
| Molecular Weight | 301.09 g/mol |
| LogP | 2.8782 |
| Topological Polar Surface Area | 87.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.08627 |
| Heavy Atoms | 22 |
| Complexity | 776.37805 |
Chemical Identifiers
| CAS Number | 384351-73-9 |
|---|---|
| SMILES | C1C(NN=C1C2=C(C=CC(=C2)[N+](=O)[O-])O)C3=CC=CC=C3F |
Product Overview
6-[5-(2-Fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone (CAS 384351-73-9), with molecular formula C15H12FN3O3 and molecular weight 301.09 g/mol. IUPAC: 2-[5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-4-nitrophenol.
Chemical Property Profile of 6-[5-(2-Fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone
Property Insights of 6-[5-(2-Fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone
The XLogP value of 2.8782 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-[5-(2-Fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone. The TPSA of 87.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[5-(2-Fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone. Following Lipinski's Rule of Five, 6-[5-(2-Fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone has 2 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 6-[5-(2-Fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone?
The CAS number of 6-[5-(2-Fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone is 384351-73-9.
What is the molecular formula of 6-[5-(2-Fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone?
The molecular formula of 6-[5-(2-Fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone is C15H12FN3O3.
What is the molecular weight of 6-[5-(2-Fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone?
The molecular weight of 6-[5-(2-Fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone is 301.09 g/mol.
Where can I buy 6-[5-(2-Fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone?
You can request a quote for 6-[5-(2-Fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-[5-(2-Fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone?
Yes, KEHONG BIO provides custom synthesis services for 6-[5-(2-Fluorophenyl)-3-pyrazolidinylidene]-4-nitro-1-cyclohexa-2,4-dienone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.