![(4E)-4-[(3-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione structure](/static/products/4590/4590-81-2.webp)
(4E)-4-[(3-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
TL;DR: (4E)-4-[(3-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione (CAS 4590-81-2) is a chemical compound with molecular formula C17H14N2O2 and molecular weight 278.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(3-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
Also Known As: BAS 02380163, BIM-0005356.P001, (4E)-4-(3-methylbenzylidene)-1-phenylpyrazolidine-3,5-dione, (4E)-4-[(3-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione, 4-(3-methylbenzylidene)-1-phenyl-3,5-pyrazolidinedione
| Molecular Formula | C17H14N2O2 |
|---|---|
| Molecular Weight | 278.11 g/mol |
| LogP | 2.45642 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.10553 |
| Heavy Atoms | 21 |
| Complexity | 735.46515 |
Chemical Identifiers
| CAS Number | 4590-81-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)/C=C/2\C(=O)NN(C2=O)C3=CC=CC=C3 |
Product Overview
(4E)-4-[(3-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione (CAS 4590-81-2), with molecular formula C17H14N2O2 and molecular weight 278.11 g/mol. IUPAC: (4E)-4-[(3-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione.
Chemical Property Profile of (4E)-4-[(3-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
Property Insights of (4E)-4-[(3-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
The XLogP value of 2.45642 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4E)-4-[(3-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione. With a topological polar surface area (TPSA) of 49.41 Ų, (4E)-4-[(3-methylphenyl)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-methylphenyl)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-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione?
The CAS number of (4E)-4-[(3-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione is 4590-81-2.
What is the molecular formula of (4E)-4-[(3-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione?
The molecular formula of (4E)-4-[(3-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione is C17H14N2O2.
What is the molecular weight of (4E)-4-[(3-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione?
The molecular weight of (4E)-4-[(3-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione is 278.11 g/mol.
Where can I buy (4E)-4-[(3-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione?
You can request a quote for (4E)-4-[(3-methylphenyl)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-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione?
Yes, KEHONG BIO provides custom synthesis services for (4E)-4-[(3-methylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.