(4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
TL;DR: (4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione (CAS 423754-28-3) is a chemical compound with molecular formula C16H11FN2O2 and molecular weight 282.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
Also Known As: BIM-0039309.P001, (4E)-4-(3-fluorobenzylidene)-1-phenylpyrazolidine-3,5-dione, (4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione, (4Z)-4-(3-fluorobenzylidene)-5-hydroxy-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
| Molecular Formula | C16H11FN2O2 |
|---|---|
| Molecular Weight | 282.08 g/mol |
| LogP | 2.2871 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 282.08044 |
| Heavy Atoms | 21 |
| Complexity | 740.952 |
Chemical Identifiers
| CAS Number | 423754-28-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC(=CC=C3)F)/C(=O)N2 |
Product Overview
(4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione (CAS 423754-28-3), with molecular formula C16H11FN2O2 and molecular weight 282.08 g/mol. IUPAC: (4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione.
Chemical Property Profile of (4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
Property Insights of (4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
The XLogP value of 2.2871 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione. With a topological polar surface area (TPSA) of 49.41 Ų, (4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione has 1 hydrogen bond donor(s) and 2 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 (4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione?
The CAS number of (4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione is 423754-28-3.
What is the molecular formula of (4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione?
The molecular formula of (4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione is C16H11FN2O2.
What is the molecular weight of (4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione?
The molecular weight of (4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione is 282.08 g/mol.
Where can I buy (4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione?
You can request a quote for (4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione?
Yes, KEHONG BIO provides custom synthesis services for (4E)-4-[(3-fluorophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.